3-methyl-4-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide

Description

3-methyl-4-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide : no description available [CHeBI]

Cross-References

ID Source	ID
PubMed CID	3301126
CHEMBL ID	1570963
CHEBI ID	92692

Synonyms (26)

Synonym
3-methyl-4-nitro-n-(1h-1,2,4-triazol-5-yl)benzamide
OPREA1_128058
3-methyl-4-nitro-n-4h-1,2,4-triazol-3-ylbenzamide
smr000196233
MLS000574799 ,
OPREA1_591594
MLS-0223293.0001 ,
EU-0035649
3-methyl-4-nitro-n-(4h-1,2,4-triazol-3-yl)benzamide
STK057753
MLS002460490
AKOS002284923
HMS2218K13
AKOS005387247
HMS3358G18
AB00118793-01
Z992054122
CHEMBL1570963
cid_3301126
bdbm51413
cambridge id 6773272
CHEBI:92692
SR-01000407605-1
sr-01000407605
Q27164394
3-methyl-4-nitro-n-(1h-1,2,4-triazol-3-yl)benzamide

Drug Classes (1)

Class	Description
C-nitro compound	A nitro compound having the nitro group (-NO2) attached to a carbon atom.

Protein Targets (8)

Potency Measurements

Protein	Taxonomy	Measurement	Average (mM)	Bioassay(s)
apical membrane antigen 1, AMA1	Plasmodium falciparum 3D7	Potency	3.5481	AID720542
bromodomain adjacent to zinc finger domain 2B	Homo sapiens (human)	Potency	50.1187	AID504333
chromobox protein homolog 1	Homo sapiens (human)	Potency	89.1251	AID540317
importin subunit beta-1 isoform 1	Homo sapiens (human)	Potency	29.0929	AID540253
snurportin-1	Homo sapiens (human)	Potency	29.0929	AID540253
GTP-binding nuclear protein Ran isoform 1	Homo sapiens (human)	Potency	29.0929	AID540253
nuclear receptor ROR-gamma isoform 1	Mus musculus (house mouse)	Potency	35.4813	AID2546; AID2551

Activation Measurements

Protein	Taxonomy	Measurement	Average (mM)	Bioassay(s)
alkaline phosphatase, tissue-nonspecific isozyme isoform 1 preproprotein	Homo sapiens (human)	EC50	7.6000	AID1659

Bioassays (9)

Assay ID	Title	Year	Journal	Article
AID504812	Inverse Agonists of the Thyroid Stimulating Hormone Receptor: HTS campaign	2010	Endocrinology, Jul, Volume: 151, Issue:7 ISSN: 1945-7170	A small molecule inverse agonist for the human thyroid-stimulating hormone receptor.
AID504810	Antagonists of the Thyroid Stimulating Hormone Receptor: HTS campaign	2010	Endocrinology, Jul, Volume: 151, Issue:7 ISSN: 1945-7170	A small molecule inverse agonist for the human thyroid-stimulating hormone receptor.
AID588501	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set	2010	Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300	Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588501	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set	2006	Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5 ISSN: 1552-4922	Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588501	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set	2010	Assay and drug development technologies, Feb, Volume: 8, Issue:1 ISSN: 1557-8127	High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID588497	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set	2010	Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300	Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588497	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set	2006	Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5 ISSN: 1552-4922	Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588497	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set	2010	Assay and drug development technologies, Feb, Volume: 8, Issue:1 ISSN: 1557-8127	High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID1745845	Primary qHTS for Inhibitors of ATXN expression	2022	The Journal of biological chemistry, 08, Volume: 298, Issue:8 ISSN: 1083-351X
AID651635	Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression	2022	The Journal of biological chemistry, 08, Volume: 298, Issue:8 ISSN: 1083-351X
AID588499	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set	2010	Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300	Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588499	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set	2006	Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5 ISSN: 1552-4922	Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588499	High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set	2010	Assay and drug development technologies, Feb, Volume: 8, Issue:1 ISSN: 1557-8127	High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID1794808	Fluorescence-based screening to identify small molecule inhibitors of Plasmodium falciparum apicoplast DNA polymerase (Pf-apPOL).	2014	Journal of biomolecular screening, Jul, Volume: 19, Issue:6 ISSN: 1552-454X	A High-Throughput Assay to Identify Inhibitors of the Apicoplast DNA Polymerase from Plasmodium falciparum.
AID1794808	Fluorescence-based screening to identify small molecule inhibitors of Plasmodium falciparum apicoplast DNA polymerase (Pf-apPOL).	2022	Journal of enzyme inhibition and medicinal chemistry, Dec, Volume: 37, Issue:1 ISSN: 1475-6374
AID1159537	qHTS screening for TAG (triacylglycerol) accumulators in algae	2017	Plant physiology, Aug, Volume: 174, Issue:4 ISSN: 1532-2548	Identification and Metabolite Profiling of Chemical Activators of Lipid Accumulation in Green Algae.

Research

Studies (8)

Timeframe	Studies, This Drug (%)	All Drugs %
pre-1990	0 (0.00)	18.7374
1990's	0 (0.00)	18.2507
2000's	1 (12.50)	29.6817
2010's	5 (62.50)	24.3611
2020's	2 (25.00)	2.80

Study Types

Publication Type	This drug (%)	All Drugs (%)
Trials	0 (0.00%)	5.53%
Reviews	0 (0.00%)	6.00%
Case Studies	0 (0.00%)	4.05%
Observational	0 (0.00%)	0.25%
Other	8 (100.00%)	84.16%

Substance	Classes	Roles	Relationship Strength
dinitrochlorobenzene	C-nitro compound; monochlorobenzenes	allergen; epitope; sensitiser	low
levoplast	C-nitro compound		low
4-nitrobenzaldehyde	benzaldehydes; C-nitro compound		low
parathion	C-nitro compound; organic thiophosphate; organothiophosphate insecticide	acaricide; agrochemical; avicide; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; mouse metabolite	low
3-nitropropionic acid	C-nitro compound	antimycobacterial drug; EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor; mycotoxin; neurotoxin	low
aristolochic acid i	aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound	carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin	low
azathioprine	aryl sulfide; C-nitro compound; imidazoles; thiopurine	antimetabolite; antineoplastic agent; carcinogenic agent; DNA synthesis inhibitor; hepatotoxic agent; immunosuppressive agent; prodrug	low
bay-k-8644	(trifluoromethyl)benzenes; C-nitro compound; dihydropyridine; methyl ester		low
benefin	C-nitro compound; organofluorine compound; substituted aniline; tertiary amino compound	agrochemical; herbicide	low
dimetridazole	C-nitro compound; imidazoles	antiparasitic agent; antiprotozoal drug	low
etanidazole	C-nitro compound; imidazoles; monocarboxylic acid amide	alkylating agent; antineoplastic agent; prodrug; radiosensitizing agent	low
flunitrazepam	1,4-benzodiazepinone; C-nitro compound; monofluorobenzenes	anxiolytic drug; GABAA receptor agonist; sedative	low
methyl parathion	C-nitro compound; organic thiophosphate; organothiophosphate insecticide	acaricide; agrochemical; antifungal agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; environmental contaminant; genotoxin	low
metronidazole	C-nitro compound; imidazoles; primary alcohol	antiamoebic agent; antibacterial drug; antimicrobial agent; antiparasitic agent; antitrichomonal drug; environmental contaminant; prodrug; radiosensitizing agent; xenobiotic	low
nicardipine	benzenes; C-nitro compound; diester; dihydropyridine; methyl ester; tertiary amino compound		low
niclosamide	benzamides; C-nitro compound; monochlorobenzenes; salicylanilides; secondary carboxamide	anthelminthic drug; anticoronaviral agent; antiparasitic agent; apoptosis inducer; molluscicide; piscicide; STAT3 inhibitor	low
nifedipine	C-nitro compound; dihydropyridine; methyl ester	calcium channel blocker; human metabolite; tocolytic agent; vasodilator agent	low
nilutamide	(trifluoromethyl)benzenes; C-nitro compound; imidazolidinone	androgen antagonist; antineoplastic agent	low
nimesulide	aromatic ether; C-nitro compound; sulfonamide	cyclooxygenase 2 inhibitor; non-steroidal anti-inflammatory drug	low
nimetazepam	1,4-benzodiazepinone; C-nitro compound	anticonvulsant; antispasmodic drug; GABA modulator; sedative	low
nimodipine	2-methoxyethyl ester; C-nitro compound; dicarboxylic acids and O-substituted derivatives; diester; dihydropyridine; isopropyl ester	antihypertensive agent; calcium channel blocker; cardiovascular drug; vasodilator agent	low
nisoldipine	C-nitro compound; dicarboxylic acids and O-substituted derivatives; diester; dihydropyridine; methyl ester		low
nitrazepam	1,4-benzodiazepinone; C-nitro compound	anticonvulsant; antispasmodic drug; drug metabolite; GABA modulator; sedative	low
nitrendipine	C-nitro compound; dicarboxylic acids and O-substituted derivatives; diester; dihydropyridine; ethyl ester; methyl ester	antihypertensive agent; calcium channel blocker; geroprotector; vasodilator agent	low
nizatidine	1,3-thiazoles; C-nitro compound; carboxamidine; organic sulfide; tertiary amino compound	anti-ulcer drug; cholinergic drug; H2-receptor antagonist	low
n-(2-cyclohexyloxy-4-nitrophenyl)methanesulfonamide	aromatic ether; C-nitro compound; sulfonamide	antineoplastic agent; cyclooxygenase 2 inhibitor	low
oxamniquine	aromatic primary alcohol; C-nitro compound; quinolines; secondary amino compound		low
4-nitrophenylacetic acid	C-nitro compound; phenylacetic acids		low
ronidazole	C-nitro compound; carbamate ester; imidazoles	antiparasitic agent; antiprotozoal drug	low
trifluralin	(trifluoromethyl)benzenes; C-nitro compound; substituted aniline	agrochemical; environmental contaminant; herbicide; xenobiotic	low
4-nitroquinoline-1-oxide	C-nitro compound; quinoline N-oxide	carcinogenic agent	low
chloramphenicol	C-nitro compound; carboxamide; diol; organochlorine compound	antibacterial drug; antimicrobial agent; Escherichia coli metabolite; geroprotector; Mycoplasma genitalium metabolite; protein synthesis inhibitor	low
niridazole	1,3-thiazoles; C-nitro compound		low
dinitrofluorobenzene	C-nitro compound; organofluorine compound	agrochemical; allergen; chromatographic reagent; EC 2.7.3.2 (creatine kinase) inhibitor; protein-sequencing agent; spectrophotometric reagent	low
nifenalol	C-nitro compound		low
chloropicrin	C-nitro compound; one-carbon compound; organochlorine compound	antifungal agrochemical; fumigant insecticide; nematicide	low
quintozene	aromatic fungicide; C-nitro compound; pentachlorobenzenes	antifungal agrochemical	low
musk ambrette (artificial)	C-nitro compound		low
1-chloro-2-nitrobenzene	C-nitro compound; monochlorobenzenes		low
picryl chloride	C-nitro compound; monochlorobenzenes	allergen; epitope; explosive; hapten	low
picric acid	C-nitro compound	antiseptic drug; explosive; fixative	low
2,4-dinitrobenzenesulfonic acid	arenesulfonic acid; C-nitro compound		low
2-nitro-4-methylaniline	C-nitro compound		low
3,5-dinitrobenzoic acid	benzoic acids; C-nitro compound		low
5-nitro-2-toluidine	C-nitro compound		low
4-chloronitrobenzene	C-nitro compound		low
4-nitrobenzyl chloride	benzyl chlorides; C-nitro compound	mutagen	low
4-nitroacetophenone	acetophenones; C-nitro compound		low
tecnazene	aromatic fungicide; C-nitro compound; tetrachlorobenzene	antifungal agrochemical	low
4-amino-2-nitrotoluene	C-nitro compound		low
2-amino-5-nitrothiazole	C-nitro compound; thiazoles		low
naphthol yellow	C-nitro compound; naphthalenesulfonic acid; naphthols	histological dye	low
azomycin	C-nitro compound; imidazoles	antitubercular agent	low
trinitrobenzenesulfonic acid	arenesulfonic acid; C-nitro compound	epitope; explosive; reagent	low
2-nitrobenzaldehyde	benzaldehydes; C-nitro compound		low
1-bromo-2,4-dinitrobenzene	C-nitro compound; organobromine compound		low
3,5-dinitrosalicylic acid	C-nitro compound; monohydroxybenzoic acid	hapten	low
3,5-dinitrotoluene	C-nitro compound		low
2-methyl-5-nitroimidazole	C-nitro compound; imidazoles		low
5-nitro-2-furaldehyde	C-nitro compound; furans		low
4-nitrophenyl acetate	C-nitro compound; phenyl acetates		low
methylparaoxon	C-nitro compound		low
dinobuton	C-nitro compound		low
pyrrolnitrin	alkaloid; C-nitro compound; monochlorobenzenes; pyrroles	antifungal drug; bacterial metabolite	low
dinoterb	C-nitro compound; phenols		low
2,4-dinitrothiocyanatobenzene	C-nitro compound; thiocyanates	hapten; tolerogen	low
2,4,6-trichlorophenyl 4-nitrophenyl ether	aromatic ether; C-nitro compound; chlorobenzenes	EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor; herbicide	low
n-methylamino-2-nitro-4-n',n'-bis(2-hydroxyethyl)aminobenzene	C-nitro compound		low
4-nitroimidazole	C-nitro compound; imidazoles		low
2-(alpha-thenoylamino)-2-nitro-5-thiazole	1,3-thiazoles; C-nitro compound		low
nitroxoline	C-nitro compound; monohydroxyquinoline	antifungal agent; antiinfective agent; antimicrobial agent; renal agent	low
nitralin	C-nitro compound		low
1,2-epoxy-3-(p-nitrophenoxy)propane	aromatic ether; C-nitro compound; epoxide		low
nimorazole	C-nitro compound; imidazoles		low
4-chloro-7-nitrobenzofurazan	benzoxadiazole; C-nitro compound; organochlorine compound	EC 1.4.3.4 (monoamine oxidase) inhibitor; EC 3.6.1.3 (adenosinetriphosphatase) inhibitor; fluorescent probe; fluorochrome	low
ipronidazole	C-nitro compound; imidazoles		low
ornidazole	C-nitro compound; imidazoles; organochlorine compound; secondary alcohol	antiamoebic agent; antibacterial drug; antiinfective agent; antiprotozoal drug; antitrichomonal drug; epitope	low
oryzalin	aromatic amine; C-nitro compound; sulfonamide; tertiary amino compound	agrochemical; antimitotic; herbicide	low
fenitrothion	C-nitro compound; organic thiophosphate	acaricide; agrochemical; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; insecticide	low
benzonidazole	C-nitro compound; imidazoles; monocarboxylic acid amide	antiprotozoal drug	low
N-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-1-(5-nitro-2-furanyl)methanimine	C-nitro compound; furans		low
3-nitro-1-propanol	C-nitro compound		low
amoscanate	C-nitro compound; isothiocyanate; secondary amino compound	schistosomicide drug	low
profluralin	C-nitro compound		low
dinitramine	C-nitro compound		low
hc blue no. 2	C-nitro compound		low
fluchloralin	C-nitro compound		low
butralin	C-nitro compound		low
isopropalin	C-nitro compound		low
pendimethalin	C-nitro compound; secondary amino compound; substituted aniline	agrochemical; environmental contaminant; herbicide	low
ethafluralin	C-nitro compound		low
acifluorfen	aromatic ether; benzoic acids; C-nitro compound; monocarboxylic acid; organochlorine compound; organofluorine compound	agrochemical; EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor; herbicide	low
bromethalin	C-nitro compound		low
fomesafen	aromatic ether; C-nitro compound; monochlorobenzenes; N-sulfonylcarboxamide; organofluorine compound; phenols	agrochemical; EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor; herbicide	low
bmy 25067	C-nitro compound; organic disulfide	antineoplastic agent	low
2-Amino-5-(5-nitro-2-furyl)-1,3,4-thiadiazole	C-nitro compound; furans		low
musk xylene	C-nitro compound	carcinogenic agent; explosive; fragrance	low
4-nitrophenylalanine	C-nitro compound		low
4-nitrobenzyl bromide	benzyl bromides; C-nitro compound	allergen; sensitiser	low
nitarsone	C-nitro compound; organoarsonic acid	agrochemical; antiprotozoal drug	low
5'-nitro-2'-propoxyacetanilide	aromatic ether; C-nitro compound		low
cinitapride	aromatic ether; C-nitro compound		low
5-nitrouracil	C-nitro compound		low
3-nitrobenzyl alcohol	C-nitro compound		low
4-nitrobenzyl alcohol	benzyl alcohols; C-nitro compound	xenobiotic metabolite	low
secnidazole	C-nitro compound; imidazoles; secondary alcohol	epitope	low
4-nitrophenyl palmitate	C-nitro compound; hexadecanoate ester		low
4-nitrophenyl butyrate	butyrate ester; C-nitro compound		low
2-nitrophenylacetic acid	C-nitro compound; phenylacetic acids		low
4-nitrophenyl sulfate	aryl sulfate; C-nitro compound	human metabolite	low
4-nitrophenyl-alpha-l-fucoside	alpha-L-fucoside; C-nitro compound	chromogenic compound	low
4-nitrophenylglucuronide	beta-D-glucosiduronic acid; C-nitro compound	chromogenic compound	low
chloramphenicol stearate	C-nitro compound		low
4,5-dimethoxy-2-nitrobenzaldehyde	aromatic ether; C-nitro compound		low
4-nitrophenyl beta-d-xyloside	C-nitro compound; xyloside	chromogenic compound	low
fluazinam	(trifluoromethyl)benzenes; aminopyridine; C-nitro compound; chloropyridine; monochlorobenzenes; secondary amino compound	allergen; antifungal agrochemical; apoptosis inducer; environmental contaminant; xenobiotic	low
2-nitropropanol	C-nitro compound		low
aclonifen	aromatic ether; C-nitro compound; monochlorobenzenes; primary amino compound; substituted aniline	agrochemical; carotenoid biosynthesis inhibitor; EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor; herbicide	low
4-nitrophenyl beta-d-glucoside	beta-D-glucoside; C-nitro compound	chromogenic compound	low
4-nitrophenyl alpha-glucoside	alpha-D-glucoside; C-nitro compound; monosaccharide derivative	chromogenic compound	low
bnps-skatole	aryl sulfide; bromoindole; C-nitro compound	reagent	low
nitrophenylgalactosides	beta-D-galactoside; C-nitro compound	chromogenic compound	low
6-n-(2,4-dinitrophenyl)aminohexanoic acid	C-nitro compound		low
5-nitro-2-(1-piperidinyl)pyridine	C-nitro compound		low
s-(4-nitrobenzyl)glutathione	C-nitro compound; organic sulfide; S-substituted glutathione		low
4-nitrophenyl-2-acetamido-2-deoxy-beta-d-glucopyranoside	C-nitro compound; N-acetyl-beta-D-glucosaminide	chromogenic compound	low
miserotoxin	beta-D-glucoside; C-nitro compound	phytotoxin	low
aristolochic acid ii	aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound	carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin	low
nitisinone	(trifluoromethyl)benzenes; C-nitro compound; cyclohexanones; mesotrione	EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor	low
efonidipine	C-nitro compound; carboxylic ester; dihydropyridine; tertiary amino compound		low
1-(2-hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole	C-nitro compound; imidazoles		low
pyrrolomycin a	antibiotic antifungal agent; C-nitro compound; organochlorine compound; pyrroles	antibacterial agent; bacterial metabolite	low
2,8-dinitroimipramine	C-nitro compound; dibenzoazepine; tertiary amino compound		low
7-nitrobenzoxadiazole-6-aminohexanoic acid	benzoxadiazole; C-nitro compound; epsilon-amino acid; secondary amino compound	fluorochrome	low
aristolochic acid D	aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound	carcinogenic agent; metabolite; nephrotoxin; toxin	low
ag 3-5	C-nitro compound		low
thymidine 5'-4-nitrophenyl phosphate	aryl phosphate; C-nitro compound; pyrimidine 2'-deoxyribonucleoside 5'-monophosphate		low
aristolochic acid c	aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound	carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin	low
mesotrione	aromatic ketone; beta-triketone; C-nitro compound; sulfone	carotenoid biosynthesis inhibitor; EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor; environmental contaminant; herbicide; xenobiotic	low
3-nitrotyrosine	2-nitrophenols; C-nitro compound; nitrotyrosine; non-proteinogenic alpha-amino acid		low
4-[4-(3-methyl-4-nitrophenoxy)butoxy]benzonitrile	aromatic ether; C-nitro compound		low
N-(4-nitrophenyl)-2-phenoxyacetamide	C-nitro compound		low
rubitecan	C-nitro compound; delta-lactone; pyranoindolizinoquinoline; semisynthetic derivative; tertiary alcohol	antineoplastic agent; EC 5.99.1.2 (DNA topoisomerase) inhibitor; prodrug	low
2-(3-nitrophenyl)-5-phenyl-1,3,4-oxadiazole	C-nitro compound		low
7-nitro-5-indeno[1,2-b]pyridinone	C-nitro compound		low
5-(4-nitrophenyl)-4-phenyl-2-thiazolamine	C-nitro compound		low
N1-(4H-1,2,4-triazol-4-yl)-4-nitrobenzamide	C-nitro compound		low
2-methoxy-4-[(4-methyl-1,4-diazepan-1-yl)methyl]-6-nitrophenol	aromatic ether; C-nitro compound		low
N-(6-methyl-2-pyridinyl)-5-nitro-2-furancarboxamide	C-nitro compound; furans		low
(3,5-dimethyl-1-pyrazolyl)-(2-ethyl-4-nitro-3-pyrazolyl)methanone	C-nitro compound		low
N-(4-methyl-2-pyridinyl)-5-nitro-2-furancarboxamide	C-nitro compound; furans		low
4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1H-pyrazol-3-one	C-nitro compound		low
N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide	aromatic ether; C-nitro compound		low
N-[2-(4-fluorophenyl)ethyl]-4-nitrobenzamide	C-nitro compound		low
N-(2-fluoro-5-nitrophenyl)-2,2-dimethylbutanamide	C-nitro compound		low
3-(2-methoxyphenyl)-6-(3-nitrophenyl)-1,4-dihydropyrimidin-2-one	C-nitro compound		low
3-ethyl-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine	C-nitro compound		low
5-hydroxy-7-(4-nitrophenyl)-1,3-benzoxathiol-2-one	C-nitro compound		low
1-(3,4-dimethoxyphenyl)-3-(2-methoxy-5-nitrophenyl)urea	aromatic ether; C-nitro compound		low
N-(1-ethyl-2-benzimidazolyl)-5-[(4-methyl-2-nitrophenoxy)methyl]-2-furancarboxamide	aromatic ether; C-nitro compound		low
2-[[cyclohexyl(oxo)methyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester	C-nitro compound		low
1-(3-methoxy-5-nitrophenyl)-3-(4-methylphenyl)urea	aromatic ether; C-nitro compound		low
N-(5-tert-butyl-3-isoxazolyl)-3-nitrobenzamide	C-nitro compound		low
2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]-N-(2-pyridinyl)acetamide	C-nitro compound		low
N-(2-methyl-5-nitrophenyl)-4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-2-amine	C-nitro compound		low
4-methoxy-N-[5-(4-methoxyphenyl)-4-(4-nitrophenyl)-2-thiazolyl]benzamide	C-nitro compound		low
4-methyl-2-(4-nitrophenyl)-5-thiazolecarboxylic acid	C-nitro compound		low
5-carbamoyl-4-methyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester	C-nitro compound		low
4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanoic acid	C-nitro compound		low
1-(3-fluorophenyl)-4-(4-hydroxy-3-methoxy-5-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester	aromatic ether; C-nitro compound		low
N-[5-(4-methoxyphenyl)-4-(4-nitrophenyl)-2-thiazolyl]-4-methylbenzamide	C-nitro compound		low
1,3-dimethyl-5-[[2-[2-(4-nitrophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione	aromatic ether; C-nitro compound		low
stattic	1-benzothiophenes; C-nitro compound; sulfone	antineoplastic agent; radiosensitizing agent; STAT3 inhibitor	low
2-fluoro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide	aromatic ether; C-nitro compound		low
2-amino-4-(4,5-dimethoxy-2-nitrophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile	aromatic ether; C-nitro compound		low
2,4-dichloro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide	aromatic ether; C-nitro compound		low
N2-tert-butyl-6-ethoxy-N4-(4-nitrophenyl)-1,3,5-triazine-2,4-diamine	C-nitro compound		low
N-[4-methyl-5-[2-(3-nitroanilino)-4-thiazolyl]-2-thiazolyl]acetamide	C-nitro compound		low
2-methyl-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]pentanamide	C-nitro compound		low
N-[(2-ethyl-1-piperidinyl)-sulfanylidenemethyl]-4-nitrobenzamide	C-nitro compound		low
4-[[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one	C-nitro compound		low
N-(4-chloro-3-nitrophenyl)-3-phenylbutanamide	C-nitro compound		low
3-(n,n-dimethylsulfonamido)-4-methyl-nitrobenzene	C-nitro compound; sulfonamide; toluenes	bone density conservation agent; EC 3.1.4.53 (3',5'-cyclic-AMP phosphodiesterase) inhibitor; geroprotector	low
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(4-methoxy-2-nitrophenyl)acetamide	aromatic ether; C-nitro compound		low
1-(2-fluorophenyl)-3-(4-methoxy-2-nitrophenyl)urea	aromatic ether; C-nitro compound		low
5-(2-nitrophenyl)-N-(2-thiazolyl)-2-furancarboxamide	C-nitro compound		low
ranitidine	C-nitro compound; furans; organic sulfide; tertiary amino compound	anti-ulcer drug; drug allergen; environmental contaminant; H2-receptor antagonist; xenobiotic	low
carnidazole	C-nitro compound; imidazoles		low
3-chloro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide	aromatic ether; C-nitro compound		low
N-methyl-5-nitro-N-(phenylmethyl)-2-furancarboxamide	C-nitro compound; furans		low
3-nitro-N'-(2,4,6-trichlorophenyl)benzohydrazide	C-nitro compound		low
2-(2,2-dimethyl-4-oxanyl)-4-(4-nitrophenyl)thiazole	C-nitro compound		low
5-methyl-N-(3-methylphenyl)-4-nitro-1H-pyrazol-3-amine	C-nitro compound		low
3-nitro-N-[(1-oxopentylhydrazo)-sulfanylidenemethyl]benzamide	C-nitro compound		low
N-[[[2-(2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-nitrobenzamide	C-nitro compound		low
N-(4-fluorophenyl)-5-nitro-2-pyridinamine	C-nitro compound		low
2-(4-chlorophenoxy)-N-(5-nitro-2-thiazolyl)acetamide	C-nitro compound; thiazoles		low
5-nitro-2-thiophenecarboxylic acid [2-oxo-2-(1-phenylethylamino)ethyl] ester	C-nitro compound; thiophenes		low
2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(2-bromo-4-nitrophenyl)acetamide	C-nitro compound		low
4-nitrophenylhydrazine	C-nitro compound; phenylhydrazines	mutagen	low
4-(1-azepanyl)-6-hydrazinyl-N-(4-nitrophenyl)-1,3,5-triazin-2-amine	C-nitro compound		low
2-amino-7-methyl-4-(5-nitro-2-furanyl)-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile	C-nitro compound; furans		low
N4-(1,1-dioxo-3-thiolanyl)-5-nitropyrimidine-4,6-diamine	C-nitro compound		low
N4-(3-chlorophenyl)-N2-methyl-5-nitropyrimidine-2,4,6-triamine	C-nitro compound		low
4-nitrocatechol	C-nitro compound; catechols	human xenobiotic metabolite; lipoxygenase inhibitor	low
1-(1-naphthalenyl)-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]urea	aromatic ether; C-nitro compound		low
nefurthiazole	C-nitro compound; furans		low
N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-2-thiophenecarboxamide	C-nitro compound; thiophenes		low
2-[(4-aminophenyl)thio]-N-(3-nitrophenyl)acetamide	C-nitro compound		low
3-[4-(2-hydroxyethylamino)-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one	C-nitro compound		low
2-[[6-amino-2-(3-methylanilino)-5-nitro-4-pyrimidinyl]amino]ethanol	C-nitro compound		low
N4-(3-fluorophenyl)-N2-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-2,4,6-triamine	C-nitro compound		low
3-nitro-N-(2-phenylethyl)-2-pyridinamine	C-nitro compound		low
2-(4-nitrophenyl)-4-thiazolecarboxylic acid ethyl ester	C-nitro compound		low
N-(4-bromophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine	C-nitro compound		low
2,4-dinitrophenylhydrazine	C-nitro compound; phenylhydrazines	reagent	low
3-methyl-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]butanamide	C-nitro compound		low
5-methyl-2-[[(4-nitrophenyl)-oxomethyl]hydrazo]-4-thiazolecarboxylic acid ethyl ester	C-nitro compound		low
N-(2-chlorophenyl)-4-[[(2-methoxy-4-nitroanilino)-sulfanylidenemethyl]hydrazo]-4-oxobutanamide	aromatic ether; C-nitro compound		low
5-nitro-2-thiophenecarboxylic acid [1-[(3,5-dichloro-2-pyridinyl)amino]-1-oxopropan-2-yl] ester	C-nitro compound; thiophenes		low
N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-4-nitroaniline	C-nitro compound		low
4-nitrocaramiphen	C-nitro compound		low
4-[(3-methyl-5-nitro-4-imidazolyl)amino]phenol	C-nitro compound; imidazoles		low
N-(2-methoxy-4-nitrophenyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide	aromatic ether; C-nitro compound		low
N2-(3-methylphenyl)-6-(4-morpholinyl)-5-nitropyrimidine-2,4-diamine	C-nitro compound		low
sb 415286	C-nitro compound; maleimides; monochlorobenzenes; phenols; secondary amino compound; substituted aniline	antioxidant; apoptosis inducer; EC 2.7.11.26 (tau-protein kinase) inhibitor; neuroprotective agent	low
N-[3-(N-(2-chloro-1-oxoethyl)-4-nitroanilino)propyl]-2,2,2-trifluoroacetamide	C-nitro compound; secondary carboxamide; tertiary carboxamide; trifluoroacetamide		low
2-[[6-amino-2-[3-(dimethylamino)propylamino]-5-nitro-4-pyrimidinyl]amino]ethanol	C-nitro compound		low
4-(3-chlorophenyl)sulfonyl-N-cyclohexyl-N-methyl-3-nitrobenzamide	C-nitro compound		low
6-(2-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine	C-nitro compound		low
1-(5-nitro-2-thiophenyl)piperidine	C-nitro compound; thiophenes		low
N-[2-(2,4,6-trinitrophenyl)ethyl]aniline	C-nitro compound		low
2-nitro-4-phenylenediamine	C-nitro compound; primary amino compound		low
N2-(2-furanylmethyl)-5-nitro-6-(1-pyrrolidinyl)pyrimidine-2,4-diamine	C-nitro compound		low
1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone	C-nitro compound		low
N-(2-bromo-4-nitrophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide	C-nitro compound		low
5-nitro-2-thiophenecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester	C-nitro compound; thiophenes		low
2-(2,3-dihydroxypropylamino)-5-nitro-3-pyridinecarbonitrile	C-nitro compound		low
2-[(2-nitrophenyl)thio]-1-cyclooctanone	C-nitro compound		low
5-nitro-2-thiophenecarboxylic acid [2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl] ester	C-nitro compound; thiophenes		low
N2-(2-furanylmethyl)-6-(3-methyl-1-piperidinyl)-5-nitropyrimidine-2,4-diamine	C-nitro compound		low
N'-(4-nitrophenyl)-9-oxo-3-bicyclo[3.3.1]nonanecarbohydrazide	C-nitro compound		low
alsterpaullone	C-nitro compound; caprolactams; organic heterotetracyclic compound	anti-HIV-1 agent; antineoplastic agent; apoptosis inducer; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor; EC 2.7.11.22 (cyclin-dependent kinase) inhibitor; EC 2.7.11.26 (tau-protein kinase) inhibitor	low
2-(4-fluoro-3-nitrophenyl)-4,4-dimethyl-5H-oxazole	C-nitro compound		low
1,2-diamino-4-nitrobenzene	C-nitro compound; primary amino compound		low
N'-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-nitrobenzohydrazide	C-nitro compound		low
furylfuramide	acrylamides; C-nitro compound; nitrofuran antibiotic; primary carboxamide		low
cilnidipine	2-methoxyethyl ester; C-nitro compound; dihydropyridine	antihypertensive agent; calcium channel blocker; cardiovascular drug	low
ro 61-8048	C-nitro compound		low
meptyldinocap	C-nitro compound; enoate ester		low
l796778	benzenes; C-nitro compound; L-lysine derivative; L-phenylalanine derivative; methyl ester; oligopeptide; secondary carboxamide; ureas	somatostatin receptor agonist	low
amocarzine	C-nitro compound; N-methylpiperazine; secondary amino compound; thioureas	antinematodal drug	low
nitrovin	C-nitro compound; furans		low
dihydroxymethylfuratrizine	C-nitro compound; furans		low
nifurpirinol	C-nitro compound; furans		low
azanidazole	C-nitro compound; imidazoles		low
aureothin	4-pyranones; C-nitro compound; ketene acetal; olefinic compound; oxolanes	antibacterial agent; antifungal agent; antineoplastic agent; antiparasitic agent; bacterial metabolite; EC 1.6.5.3 [NADH:ubiquinone reductase (H(+)-translocating)] inhibitor	low
nidroxyzone	C-nitro compound; furans		low
nifurzide	C-nitro compound; thiophenes		low
abt-737	aromatic amine; aryl sulfide; biphenyls; C-nitro compound; monochlorobenzenes; N-arylpiperazine; N-sulfonylcarboxamide; secondary amino compound; tertiary amino compound	anti-allergic agent; anti-inflammatory agent; antineoplastic agent; apoptosis inducer; B-cell lymphoma 2 inhibitor	low
5-(5-nitrothiazol-2-ylthio)-1,3,4-thiadiazol-2-amine	1,3-thiazoles; C-nitro compound; organic sulfide; primary amino compound; thiadiazoles	antibacterial agent; c-Jun N-terminal kinase inhibitor	low
[4-(2-chlorophenyl)sulfonyl-3-nitrophenyl]-[4-(phenylmethyl)-1-piperazinyl]methanone	C-nitro compound		low
2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-nitrophenyl)acetamide	C-nitro compound		low
2',3'-o-(2,4,6-trinitrophenyl)adenosine 5'-triphosphate	C-nitro compound; spiroketal	antagonist	low
2-(4-morpholinyl)-N'-[(2-nitrophenyl)-oxomethyl]-4-thiazolecarbohydrazide	C-nitro compound		low
N'-[(2-methyl-3-nitrophenyl)-oxomethyl]-2-(4-morpholinyl)-4-thiazolecarbohydrazide	C-nitro compound		low
ML-210	C-nitro compound; diarylmethane; isoxazoles; monochlorobenzenes; N-acylpiperazine; N-alkylpiperazine; tertiary carboxamide	antineoplastic agent; EC 1.11.1.9 (glutathione peroxidase) inhibitor; ferroptosis inducer; prodrug	low
abt-199	aromatic ether; C-nitro compound; monochlorobenzenes; N-alkylpiperazine; N-arylpiperazine; N-sulfonylcarboxamide; oxanes; pyrrolopyridine	antineoplastic agent; apoptosis inducer; B-cell lymphoma 2 inhibitor	low
chir 98014	aminopyrimidine; C-nitro compound; diaminopyridine; dichlorobenzene; imidazoles; secondary amino compound	antineoplastic agent; apoptosis inducer; EC 2.7.11.26 (tau-protein kinase) inhibitor; hypoglycemic agent; tau aggregation inhibitor; Wnt signalling activator	low
acenocoumarol	C-nitro compound; hydroxycoumarin; methyl ketone	anticoagulant; EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor	low
8-nitroguanosine 3',5'-cyclic monophosphate	3',5'-cyclic purine nucleotide; C-nitro compound	biomarker; Brassica napus metabolite; human metabolite; signalling molecule	low

Substance	Studies	Classes	Roles	First Year	Last Year	Average Age	Relationship Strength	2010's
levoplast	1	C-nitro compound		2017	2017	7.0	low	1
hippuric acid	1	N-acylglycine	human blood serum metabolite; uremic toxin	2017	2017	7.0	low	1
xanthine	1	xanthine	Saccharomyces cerevisiae metabolite	2017	2017	7.0	low	1
atrolactic acid	1	2-hydroxy monocarboxylic acid		2017	2017	7.0	low	1
etofylline	1	oxopurine		2017	2017	7.0	low	1
n-acetyltryptophan	1	N-acetyl-amino acid; tryptophan derivative	metabolite	2017	2017	7.0	low	1
ethacridine	1	acridines		2017	2017	7.0	low	1
altretamine	1	triamino-1,3,5-triazine		2017	2017	7.0	low	1
2,5-di-tert-butylhydroquinone	1	hydroquinones		2017	2017	7.0	low	1
cx546	1			2017	2017	7.0	low	1
diphenhydramine	1	ether; tertiary amino compound	anti-allergic agent; antidyskinesia agent; antiemetic; antiparkinson drug; antipruritic drug; antitussive; H1-receptor antagonist; local anaesthetic; muscarinic antagonist; oneirogen; sedative	2017	2017	7.0	low	1
diuron	1	3-(3,4-substituted-phenyl)-1,1-dimethylurea; dichlorobenzene	environmental contaminant; mitochondrial respiratory-chain inhibitor; photosystem-II inhibitor; urea herbicide; xenobiotic	2017	2017	7.0	low	1
ibuprofen	1	monocarboxylic acid	antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; environmental contaminant; geroprotector; non-narcotic analgesic; non-steroidal anti-inflammatory drug; radical scavenger; xenobiotic	2017	2017	7.0	low	1
ipriflavone	1	aromatic ether; isoflavones	bone density conservation agent	2017	2017	7.0	low	1
mebendazole	1	aromatic ketone; benzimidazoles; carbamate ester	antinematodal drug; microtubule-destabilising agent; tubulin modulator	2017	2017	7.0	low	1
nocodazole	1	aromatic ketone; benzimidazoles; carbamate ester; thiophenes	antimitotic; antineoplastic agent; microtubule-destabilising agent; tubulin modulator	2017	2017	7.0	low	1
piribedil	1	N-arylpiperazine		2017	2017	7.0	low	1
procainamide	1	benzamides	anti-arrhythmia drug; platelet aggregation inhibitor; sodium channel blocker	2017	2017	7.0	low	1
prometone	1	diamino-1,3,5-triazine; methoxy-1,3,5-triazine	environmental contaminant; herbicide; xenobiotic	2017	2017	7.0	low	1
propanil	1	anilide; dichlorobenzene	herbicide	2017	2017	7.0	low	1
sulfadimethoxine	1	aromatic ether; pyrimidines; substituted aniline; sulfonamide antibiotic; sulfonamide	antiinfective agent; antimicrobial agent; drug allergen; environmental contaminant; xenobiotic	2017	2017	7.0	low	1
sulfamethazine	1	pyrimidines; sulfonamide antibiotic; sulfonamide	antibacterial drug; antiinfective agent; antimicrobial agent; carcinogenic agent; drug allergen; EC 2.5.1.15 (dihydropteroate synthase) inhibitor; environmental contaminant; ligand; xenobiotic	2017	2017	7.0	low	1
sulfathiazole	1	1,3-thiazoles; substituted aniline; sulfonamide antibiotic; sulfonamide	antiinfective agent; drug allergen; EC 2.5.1.15 (dihydropteroate synthase) inhibitor; environmental contaminant; xenobiotic	2017	2017	7.0	low	1
testosterone	1	3-hydroxy steroid	androgen	2017	2017	7.0	medium	1
2-hydroxybenzylbenzimidazole	1			2017	2017	7.0	low	1
etimizol	1			2017	2017	7.0	low	1
nifenalol	1	C-nitro compound		2017	2017	7.0	low	1
bis(4-hydroxyphenyl)sulfone	1	bisphenol; sulfone	endocrine disruptor; metabolite	2017	2017	7.0	low	1
8-hydroxyquinoline-5-sulfonic acid	1			2017	2017	7.0	low	1
salicylanilide	1	benzanilide fungicide; salicylamides; salicylanilides		2017	2017	7.0	low	1
2-phenylbutyric acid	1	benzenes; monocarboxylic acid	human xenobiotic metabolite	2017	2017	7.0	low	1
4,4'-dimethoxybenzophenone	1			2017	2017	7.0	medium	1
6-phenyl-1,3,5-triazine-2,4-diamine	1			2017	2017	7.0	low	1
quinaldic acid	1	quinolinemonocarboxylic acid	human metabolite; Saccharomyces cerevisiae metabolite	2017	2017	7.0	low	1
N-(2-methoxyphenyl)acetamide	1	acetamides; methoxybenzenes		2017	2017	7.0	low	1
fast red b	1			2017	2017	7.0	low	1
methylenebis(chloroaniline)	1	chloroaniline	metabolite	2017	2017	7.0	low	1
di-(4-aminophenyl)ether	1	aromatic ether		2017	2017	7.0	low	1
diphenylguanidine	1	guanidines	allergen	2017	2017	7.0	low	1
4-Anilino-4-oxobutanoic acid	1	anilide		2017	2017	7.0	high	1
mephobarbital	1	barbiturates	anticonvulsant	2017	2017	7.0	low	1
etryptamine	1	indoles		2017	2017	7.0	low	1
sulfacetamide	1			2017	2017	7.0	low	1
cinchophen	1	quinolines		2017	2017	7.0	low	1
2-aminobenzothiazole	1	benzothiazoles		2017	2017	7.0	low	1
carzenide	1	sulfonamide		2017	2017	7.0	low	1
nitrilotriacetic acid	1	NTA; tricarboxylic acid	carcinogenic agent; nephrotoxic agent	2017	2017	7.0	low	1
n-(2-cyanoethyl)-2-phenylethylamine	1			2017	2017	7.0	medium	1
cyclooctane	1			2017	2017	7.0	low	1
triphenyltetrazolium chloride	1	organic chloride salt	dye; indicator	2017	2017	7.0	medium	1
2,7-diacetylaminofluorene	1			2017	2017	7.0	medium	1
3,4-pyridinedicarboxylic acid	1	pyridinedicarboxylic acid		2017	2017	7.0	medium	1
4-(benzoylamino)-2-hydroxybenzoic acid	1	benzamides		2017	2017	7.0	low	1
tropic acid	1	3-hydroxy monocarboxylic acid	human xenobiotic metabolite	2017	2017	7.0	low	1
8-hydroxy-7-iodo-5-quinolinesulfonic acid	1	hydroxyquinoline		2017	2017	7.0	low	1
1-acetylisatin	1	indoledione		2017	2017	7.0	medium	1
4-cumylphenol	1	diarylmethane		2017	2017	7.0	low	1
5-methylisatin	1			2017	2017	7.0	low	1
2-hydrazinobenzothiazole	1			2017	2017	7.0	low	1
1,2,3-trimethoxybenzene	1	methoxybenzenes	plant metabolite	2017	2017	7.0	low	1
2-amino-5-chlorobenzophenone	1			2017	2017	7.0	low	1
diphenamid	1	diarylmethane		2017	2017	7.0	low	1
4-(4-nitrobenzyl)pyridine	1			2017	2017	7.0	low	1
5-methyl-3-phenylisoxazole-4-carboxylic acid	1			2017	2017	7.0	medium	1
2-acetylbenzofuran	1			2017	2017	7.0	medium	1
pyrazon	1	benzenes; organochlorine compound; primary amino compound; pyridazinone	environmental contaminant; herbicide; xenobiotic	2017	2017	7.0	low	1
2-amino-5-nitrobenzophenone	1			2017	2017	7.0	medium	1
(4-tert-Butyl-phenoxy)-acetic acid	1	monocarboxylic acid		2017	2017	7.0	low	1
lenacil	1	cyclopentapyrimidine	agrochemical; environmental contaminant; herbicide; xenobiotic	2017	2017	7.0	low	1
chlordesmethyldiazepam	1	benzodiazepine		2017	2017	7.0	low	1
2-amino-2',5-dichlorobenzophenone	1			2017	2017	7.0	medium	1
2-(2'-hydroxyphenyl)benzimidazole	1			2017	2017	7.0	low	1
4-phthalimidobutyric acid	1			2017	2017	7.0	medium	1
azabutyrone	1			2017	2017	7.0	high	1
2-(2-hydroxyphenyl)benzothiazole	1	benzothiazoles; phenols	geroprotector	2017	2017	7.0	low	1
4,5-dichlorocatechol	1			2017	2017	7.0	low	1
n-butylbenzenesulfonamide	1	sulfonamide	neurotoxin; plant metabolite	2017	2017	7.0	low	1
3-phenoxybenzoic acid	1	phenoxybenzoic acid	human xenobiotic metabolite; marine xenobiotic metabolite	2017	2017	7.0	low	1
2-(2-hydroxyethylmercapto)benzothiazole	1			2017	2017	7.0	high	1
carboxin	1	anilide fungicide; anilide; enamide; organosulfur heterocyclic compound; oxacycle; secondary carboxamide	antifungal agrochemical; EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor	2017	2017	7.0	low	1
meturin	1			2017	2017	7.0	medium	1
2-bromo-N-phenylbenzamide	1	benzamides		2017	2017	7.0	medium	1
4-chlorohippuric acid	1			2017	2017	7.0	medium	1
4-chlorophenoxyacetic acid	1	chlorophenoxyacetic acid; monochlorobenzenes	phenoxy herbicide	2017	2017	7.0	low	1
2,5-dichloro-1,4-phenylenediamine	1			2017	2017	7.0	medium	1
metribuzin	1	1,2,4-triazines; cyclic ketone; organic sulfide	agrochemical; environmental contaminant; herbicide; xenobiotic	2017	2017	7.0	low	1
2,5-dimethyl-3-furancarboxanilide	1			2017	2017	7.0	low	1
moricizine hydrochloride	1	hydrochloride	anti-arrhythmia drug	2017	2017	7.0	low	1
2-benzimidazolylguanidine	1	aminoimidazole		2017	2017	7.0	low	1
diflubenzuron	1	benzoylurea insecticide; monochlorobenzenes	insect sterilant	2017	2017	7.0	low	1
pentafluorobenzoyl-n-phenylethylamine	1			2017	2017	7.0	medium	1
thidiazuron	1	ureas		2017	2017	7.0	low	1
phenthiazamine	1			2017	2017	7.0	low	1
5,5-diphenylbarbituric acid	1			2017	2017	7.0	medium	1
3-acetamidobenzoic acid	1			2017	2017	7.0	medium	1
dazoxiben hydrochloride	1			2017	2017	7.0	medium	1
succinylsulfanilamide	1			2017	2017	7.0	low	1
benzylaminopurine	1	6-aminopurines	cytokinin; plant metabolite	2017	2017	7.0	low	1
ciprofloxacin hydrochloride anhydrous	1	hydrochloride	antibacterial drug; antiinfective agent; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; topoisomerase IV inhibitor	2017	2017	7.0	low	1
src-820 r	1			2017	2017	7.0	medium	1
n(4)-acetylsulfadiazine	1	acetamides; pyrimidines; sulfonamide	marine xenobiotic metabolite	2017	2017	7.0	low	1
4-nitro-alpha-acetylamino-beta-hydroxypropiophenone	1			2017	2017	7.0	low	1
formetamide	1			2017	2017	7.0	low	1
isbufylline	1			2017	2017	7.0	low	1
phenylacetylglycine	1	monocarboxylic acid amide; monocarboxylic acid; N-acylglycine	human metabolite; mouse metabolite	2017	2017	7.0	low	1
N-benzoylanthranilic acid	1	amidobenzoic acid		2017	2017	7.0	low	1
butinoline	1	diarylmethane		2017	2017	7.0	low	1
n-(2-carboxyphenyl)glycine	1			2017	2017	7.0	low	1
n,n-dimethyl-4-anisidine	1			2017	2017	7.0	low	1
n-benzoylpiperidine	1	benzamides; N-acylpiperidine		2017	2017	7.0	low	1
2-phenylcyclopropanecarboxylic acid	1			2017	2017	7.0	low	1
n-demethylantipyrine	1	pyrazoles; ring assembly		2017	2017	7.0	medium	1
3-(2-pyridyl)-5,6-diphenyl-1,2,4-triazine	1	1,2,4-triazines		2017	2017	7.0	low	1
2-amino-5-bromopyridine	1			2017	2017	7.0	medium	1
n-benzoylalanine, (dl-ala)-isomer	1	alanine derivative; N-acyl-amino acid	metabolite	2017	2017	7.0	medium	1
bicinchoninic acid	1			2017	2017	7.0	low	1
betamipron	1	organonitrogen compound; organooxygen compound		2017	2017	7.0	low	1
benzoylpropionic acid	1	4-oxo monocarboxylic acid	hapten	2017	2017	7.0	low	1
Evoxine	1	organic heterotricyclic compound; organonitrogen heterocyclic compound; oxacycle		2017	2017	7.0	low	1
1-methyl-1,2,3,4-tetrahydro-beta-carboline-3-carboxylic acid	1	harmala alkaloid		2017	2017	7.0	low	1
N-Benzylphthalimide	1	isoindoles		2017	2017	7.0	medium	1
pyromellitic diimide	1			2017	2017	7.0	low	1
4'-bromosalicylanilide	1			2017	2017	7.0	medium	1
2,2-bis(4-hydroxyphenyl)-1,1,1-trichloroethane	1	bisphenol		2017	2017	7.0	low	1
terephthalamide	1	benzenedicarboxamide		2017	2017	7.0	medium	1
3(2h)-pyridazinone, 4-chloro-5-(dimethylamino)-2-phenyl-	1			2017	2017	7.0	low	1
2-nitrophenylacetic acid	1	C-nitro compound; phenylacetic acids		2017	2017	7.0	medium	1
onychine	1			2017	2017	7.0	high	1
4'-methoxyflavone	1	ether; flavonoids		2017	2017	7.0	low	1
1,3-diphenyl-2-aminopropane	1			2017	2017	7.0	medium	1
2,2-diphenylpropionic acid	1			2017	2017	7.0	medium	1
3,4-dimethoxyphenylacetamide	1			2017	2017	7.0	medium	1
2-amino-5-bromobenzoic acid	1			2017	2017	7.0	low	1
2-(1H-benzimidazol-2-yl)aniline	1	benzimidazoles; primary arylamine; substituted aniline	geroprotector	2017	2017	7.0	medium	1
N-Acetylhomoveratrylamine	1	acetamides		2017	2017	7.0	high	1
2-chlorobenzenesulfonamide	1			2017	2017	7.0	medium	1
4-nitrophenyl dimethylcarbamate	1			2017	2017	7.0	medium	1
8-(4-tolylsulfonylamino)quinoline	1	sulfonamide		2017	2017	7.0	low	1
5-methoxyindole-3-carbaldehyde	1	indoles		2017	2017	7.0	medium	1
2-oxo-1,2-dihydroquinoline-4-carboxylic acid	1	quinolinemonocarboxylic acid		2017	2017	7.0	medium	1
6-methoxy-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one	1	beta-carbolines		2017	2017	7.0	low	1
pd 147953	1			2017	2017	7.0	medium	1
fenozan	1			2017	2017	7.0	low	1
5-phenylbarbituric acid	1			2017	2017	7.0	medium	1
diethylpropion hydrochloride	1	hydrochloride	appetite depressant	2017	2017	7.0	low	1
1-(4'-nitrophenyl)-2-aminopropane-1,3-diol	1			2017	2017	7.0	low	1
beta-hydroxyphenylalanine	1			2017	2017	7.0	low	1
3-(n-salicyloyl)amino-1,2,4-triazole	1			2017	2017	7.0	medium	1
7-chloro-4-aminoquinoline	1	aminoquinoline		2017	2017	7.0	low	1
acridine-9-carboxylic acid	1			2017	2017	7.0	medium	1
1-phenazinecarboxylic acid	1	aromatic carboxylic acid; monocarboxylic acid; phenazines	antifungal agent; antimicrobial agent; bacterial metabolite	2017	2017	7.0	low	1
4,5-diphenyl-1,5-dihydroimidazol-2-one	1	stilbenoid		2017	2017	7.0	medium	1
2-hydroxy-1,2-bis(methoxyphenyl)ethanone	1			2017	2017	7.0	low	1
4-methyl-N-(phenylmethyl)benzenesulfonamide	1	sulfonamide		2017	2017	7.0	low	1
4-n-butylaminobenzoic acid	1	aromatic amino acid		2017	2017	7.0	low	1
fluoren-9-ol	1			2017	2017	7.0	high	1
1-(2-carboxyethyl)uracil	1			2017	2017	7.0	high	1
1-benzylindole	1			2017	2017	7.0	low	1
2,3-bis(2-pyridinyl)quinoxaline	1	quinoxaline derivative		2017	2017	7.0	low	1
3,3',5,5'-tetrachlorobiphenyl-4,4'-diol	1	dichlorobenzene; hydroxybiphenyls		2017	2017	7.0	low	1
5-nitro-2-(1-piperidinyl)pyridine	1	C-nitro compound		2017	2017	7.0	medium	1
2-amino-5,7-dimethyl-1,8-naphthyridine	1			2017	2017	7.0	medium	1
5-benzyloxytryptophan	1			2017	2017	7.0	low	1
2,5-diethoxy-4-morpholinoaniline	1			2017	2017	7.0	high	1
3-hydroxy-3-phenacyloxindole	1			2017	2017	7.0	low	1
carbobenzoxyphenylalanine, (dl-phe)-isomer	1			2017	2017	7.0	low	1
gamma-fagarine	1	organic heterotricyclic compound; organonitrogen heterocyclic compound; oxacycle		2017	2017	7.0	low	1
3-carboxymethyl-6-benzyl-2,5-diketopiperazine	1	organonitrogen compound; organooxygen compound		2017	2017	7.0	high	1
4-fluorobenzenesulfonamide	1			2017	2017	7.0	medium	1
emoxypine succinate	1			2017	2017	7.0	low	1
n-carbamyltryptophan	1			2017	2017	7.0	high	1
2,4,6-trimethoxyacetophenone	1			2017	2017	7.0	high	1
1-(2-hydroxyethyl)-3,5-diphenyl-1h-pyrazole	1			2017	2017	7.0	medium	1
4-methyoxybenzoyl-n-glycine	1	N-acylglycine		2017	2017	7.0	low	1
5-ethoxy-2-ethylmercaptobenzimidazole	1			2017	2017	7.0	low	1
5(6)-1(2h)-phthalazinonyl-4(1h)-benzimidazole-2-carbamate methyl ester	1			2017	2017	7.0	low	1
n-phenyliminodiacetic acid	1			2017	2017	7.0	medium	1
teomorfolin	1			2017	2017	7.0	medium	1
1-(1,3-benzodioxol-5-yl)-3-(1-piperidinyl)-1-propanone	1	benzodioxoles		2017	2017	7.0	medium	1
n-(aminocarbonyl)-2-chlorobenzenesulfonamide	1			2017	2017	7.0	high	1
3-hydroxy-2-quinoxalinepropionic acid	1			2017	2017	7.0	medium	1
8-(methylsulfonylamino)quinoline	1			2017	2017	7.0	low	1
n(4)-acetylsulfamonomethoxine	1			2017	2017	7.0	low	1
8-(4-benzenesulfonylamino)quinoline	1			2017	2017	7.0	low	1
methindione	1			2017	2017	7.0	medium	1
3,4-dihydroxybenzophenone	1			2017	2017	7.0	medium	1
gamma-propanol	1			2017	2017	7.0	medium	1
2-[(3-oxo-1-cyclohexenyl)amino]benzonitrile	1	benzenes; nitrile		2017	2017	7.0	medium	1
isonicotinylamide gaba	1			2017	2017	7.0	high	1
5-fluorotryptamine monohydrochloride	1			2017	2017	7.0	medium	1
4-iodo-n-(2-(4-morpholinyl)ethyl)benzamide	1			2017	2017	7.0	medium	1
3-(hydroxyacetyl)indole	1	indoles		2017	2017	7.0	low	1
n-(4-aminophenylsulfonyl)morpholine	1			2017	2017	7.0	high	1
1H-indol-3-yl-(4-methoxyphenyl)methanone	1	N-acylindole		2017	2017	7.0	medium	1
2-amino-5-phenyl-1,3,4-thiadiazole	1			2017	2017	7.0	low	1
N-(1-phenylethyl)acetamide	1	acetamides; secondary carboxamide		2017	2017	7.0	high	1
alpha-(trichloromethyl)-4-pyridineethanol	1	pyridines		2017	2017	7.0	medium	1
ml 204	1			2017	2017	7.0	low	1
eudesmin	1			2017	2017	7.0	low	1
2-amino-4-methyl-3-nitropyridine	1			2017	2017	7.0	medium	1
4,4-bis(hydroxymethyl)-2-phenyl-2-oxazoline	1			2017	2017	7.0	medium	1
n-acetylhistidine	1	histidine derivative; N-acetyl-amino acid		2017	2017	7.0	medium	1
1-(1-oxo-2-phenylethyl)-4-piperidinecarboxylic acid	1	acetamides		2017	2017	7.0	medium	1
1-(4-chlorophenyl)-3-(2-ethoxyphenyl)urea	1	ureas		2017	2017	7.0	medium	1
4-methoxyxanthone	1			2017	2017	7.0	low	1
N-(4-nitrophenyl)-2-phenoxyacetamide	1	C-nitro compound		2017	2017	7.0	medium	1
1-phenylindolin-2-one	1			2017	2017	7.0	medium	1
1-(benzenesulfonyl)indole	1	sulfonamide		2017	2017	7.0	low	1
2,4,4,6-Tetramethyl-1,4-dihydro-3,5-pyridinedicarbonitrile	1	dihydropyridine		2017	2017	7.0	medium	1
pifithrin mu	1	benzenes		2017	2017	7.0	low	1
2-benzyloxybenzaldehyde	1			2017	2017	7.0	low	1
2-guanidine-4-methylquinazoline	1			2017	2017	7.0	low	1
N-phenylcarbamic acid 2-phenoxyethyl ester	1	carbamate ester		2017	2017	7.0	medium	1
3,4-dihydro-2H-benzo[4,5]imidazo[2,1-b][1,3]thiazin-3-ol	1	benzimidazoles		2017	2017	7.0	medium	1
mequindox	1			2017	2017	7.0	low	1
N-[2-(dimethylamino)ethyl]-2,2-diphenylacetamide	1	diarylmethane		2017	2017	7.0	medium	1
Girgensonine	1	nitrile		2017	2017	7.0	medium	1
Dubinidine	1	organic heterotricyclic compound; organonitrogen heterocyclic compound; oxacycle		2017	2017	7.0	low	1
N-[4-(methanesulfonamido)phenyl]acetamide	1	sulfonamide		2017	2017	7.0	medium	1
4-(2-oxazolo[4,5-b]pyridinyl)aniline	1	1,3-oxazoles		2017	2017	7.0	medium	1
2-[(4-nitrophenyl)methylthio]-1,3-benzoxazole	1	benzoxazole		2017	2017	7.0	low	1
3-oxido-4,5-dihydro-[1,2,5]oxadiazolo[3,4-f]cinnolin-3-ium	1	pyridazines		2017	2017	7.0	medium	1
3-(2,4-difluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone	1	substituted aniline		2017	2017	7.0	medium	1
1-phenyl-4-pyrazolol	1	pyrazoles; ring assembly		2017	2017	7.0	medium	1
3-(3,5-dimethyl-1-pyrazolyl)-1,2-benzothiazole 1,1-dioxide	1	benzothiazoles		2017	2017	7.0	medium	1
3-benzamido-2-benzofurancarboxamide	1	benzofurans		2017	2017	7.0	medium	1
N-[2-(4-methoxyphenyl)ethyl]acetamide	1	acetamides		2017	2017	7.0	low	1
N-[2-(3-methylphenoxy)ethyl]-1H-1,2,4-triazole-5-carboxamide	1	aromatic ether		2017	2017	7.0	medium	1
2-(1H-indol-3-ylthio)acetic acid	1	indoles		2017	2017	7.0	low	1
3-bromo-N-[2-(4-nitroanilino)ethyl]benzamide	1	carbonyl compound; organohalogen compound		2017	2017	7.0	medium	1
3-Methylbenzofuran-2-carboxylic acid	1	benzofurans		2017	2017	7.0	high	1
5-(3,4-dimethoxyphenyl)-2H-tetrazole	1	tetrazoles		2017	2017	7.0	medium	1
1-(4-fluorophenyl)sulfonyl-4-(2-methoxyphenyl)piperazine	1	piperazines		2017	2017	7.0	medium	1
4-[[bis(2-hydroxyethyl)amino]methyl]-2,6-ditert-butylphenol	1	alkylbenzene		2017	2017	7.0	medium	1
2-phenylindole-3-carbaldehyde	1			2017	2017	7.0	medium	1
4-(2-pyridinylthio)benzofuro[3,2-d]pyrimidine	1	aryl sulfide		2017	2017	7.0	medium	1
5-(4-nitrophenyl)-4-phenyl-2-thiazolamine	1	C-nitro compound		2017	2017	7.0	medium	1
3-[6-(4-aminophenyl)-2-phenyl-4-pyrimidinyl]aniline	1	pyrimidines		2017	2017	7.0	medium	1
7-methoxyisoflavone	1	7-methoxyisoflavones		2017	2017	7.0	low	1
LSM-32392	1	monoterpenoid		2017	2017	7.0	medium	1
N-[2-(1-cyclohexenyl)ethyl]-4-(4-morpholinylmethyl)benzamide	1	benzamides		2017	2017	7.0	medium	1
1-(1-benzimidazolyl)-3-(1-cyclohex-3-enylmethoxy)-2-propanol	1	benzimidazoles		2017	2017	7.0	medium	1
N-[2-(2-furanylmethylthio)ethyl]-4-methoxybenzenesulfonamide	1	sulfonamide		2017	2017	7.0	medium	1
3-acetamido-5-chloro-2-benzofurancarboxylic acid	1	benzofurans		2017	2017	7.0	medium	1
[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(2,6-dimethoxyphenyl)methanone	1	dimethoxybenzene		2017	2017	7.0	medium	1
4-[4-methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]morpholine	1	N-arylpiperazine		2017	2017	7.0	medium	1
haplamine	1	organic heterotricyclic compound; organonitrogen heterocyclic compound; oxacycle		2017	2017	7.0	low	1
5-(3,4-dimethoxyphenyl)-1H-1,2,4-triazol-3-amine	1	triazoles		2017	2017	7.0	medium	1
2-ethoxy-N-[4-(4-morpholinylsulfonyl)phenyl]benzamide	1	benzamides		2017	2017	7.0	medium	1
2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-1-phenylethanone	1	aromatic ketone		2017	2017	7.0	medium	1
1-ethyl-6-methoxy-4-oxo-3-quinolinecarboxylic acid	1	quinolines		2017	2017	7.0	medium	1
2-(pyridin-4-yl)-4-(pyrrolidin-1-yl)quinazoline	1	pyridines; pyrrolidines; quinazolines		2017	2017	7.0	high	1
scp 1	1			2017	2017	7.0	high	1
N-(3-acetamidophenyl)-4-methoxybenzamide	1	benzamides		2017	2017	7.0	medium	1
N-(3-acetamidophenyl)-3-chlorobenzamide	1	benzamides		2017	2017	7.0	medium	1
4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide	1	benzamides		2017	2017	7.0	medium	1
N-(2-fluorophenyl)-4-phenylmethoxybenzamide	1	benzamides		2017	2017	7.0	medium	1
N-[4-(diethylamino)phenyl]-2-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
N-(2-furanylmethyl)-2-benzofurancarboxamide	1	benzofurans		2017	2017	7.0	medium	1
5-(2-phenylethyl)-1,3,4-thiadiazol-2-amine	1	aromatic amine; thiadiazoles		2017	2017	7.0	low	1
te 5	1			2017	2017	7.0	medium	1
2-[[anilino(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxamide	1	ureas		2017	2017	7.0	low	1
N-(4,6-dimethyl-2-pyrimidinyl)-1,3-benzothiazol-2-amine	1	benzothiazoles		2017	2017	7.0	low	1
6-methylflavone	1			2017	2017	7.0	low	1
2-methoxy-N-(2-pyridinyl)benzamide	1	benzamides		2017	2017	7.0	medium	1
2-chloro-N-(2-phenylethyl)benzamide	1	carbonyl compound; organohalogen compound		2017	2017	7.0	medium	1
N1-(4H-1,2,4-triazol-4-yl)-4-nitrobenzamide	1	C-nitro compound		2017	2017	7.0	medium	1
N-[2-(1-cyclohexenyl)ethyl]-4-fluorobenzamide	1	carbonyl compound; organohalogen compound		2017	2017	7.0	medium	1
tioxazafen	1	1,2,4-oxadiazole; thiophenes	agrochemical; nematicide	2017	2017	7.0	high	1
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide	1	aromatic amide		2017	2017	7.0	medium	1
1-(4-Methoxyphenyl)-2-nitroethylene	1	methoxybenzenes		2017	2017	7.0	low	1
brd32048	1	methoxybenzenes; substituted aniline		2017	2017	7.0	medium	1
2-(4-chloro-3-methylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide	1	aromatic ether		2017	2017	7.0	medium	1
2-(3,4-dichlorophenyl)imidazo[1,2-a]pyrimidine	1	imidazoles		2017	2017	7.0	medium	1
5-(2-phenyl-4-triazolyl)-2H-tetrazole	1	triazoles		2017	2017	7.0	medium	1
N-cyclohexyl-2,3-dihydroindole-1-carboxamide	1	indolyl carboxylic acid		2017	2017	7.0	medium	1
4-(benzylsulfanyl)thieno[2,3-d]pyrimidine	1	aryl sulfide; benzenes; thienopyrimidine		2017	2017	7.0	low	1
2-methyl-5-(5-methyl-2-furanyl)-3-(1-pyrrolyl)-4-thieno[2,3-d]pyrimidinone	1	organic heterobicyclic compound; organonitrogen heterocyclic compound; organosulfur heterocyclic compound		2017	2017	7.0	medium	1
1-[2-(dimethylamino)ethyl]-5-methoxy-N-methyl-2-indolecarboxamide	1	indolecarboxamide		2017	2017	7.0	medium	1
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide	1	benzamides		2017	2017	7.0	medium	1
4-(1H-benzimidazol-2-yl)quinoline	1	quinolines		2017	2017	7.0	medium	1
1-(4-Chlorophenyl)-2-[(1-methyl-1H-imidazol-2-yl)thio]ethan-1-one	1	aromatic ketone		2017	2017	7.0	high	1
N-(2,5-dimethylphenyl)-2-benzofurancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
N-(4-methoxyphenyl)-2-benzofurancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
2-(9h-xanthen-9-yl)-malonic acid	1	xanthenes		2017	2017	7.0	high	1
1-(1,3-benzothiazol-2-yl)-3-phenylurea	1	ureas		2017	2017	7.0	medium	1
1-hydroxy-2-phenyl-1,5,6,7-tetrahydro-4H-benzimidazol-4-one	1	imidazoles		2017	2017	7.0	medium	1
N-(4-acetamidophenyl)-2-bromobenzamide	1	benzamides		2017	2017	7.0	medium	1
4-bromo-N-phenacylbenzamide	1	aromatic ketone		2017	2017	7.0	medium	1
1-(2,3-dihydroindol-1-yl)-2-(phenylthio)ethanone	1	indoles		2017	2017	7.0	medium	1
N-[6-methyl-2-(4-methylphenyl)-5-benzotriazolyl]-3-pyridinecarboxamide	1	triazoles		2017	2017	7.0	medium	1
N,N-dimethyl-N'-p-tolylsulfamide	1	sulfamides	marine xenobiotic metabolite	2017	2017	7.0	medium	1
2-(1-piperidinylmethyl)phenol	1			2017	2017	7.0	medium	1
2,6-bis(benzimidazol-2-yl)pyridine	1	benzimidazoles		2017	2017	7.0	low	1
1-cyclohexyl-3-(2-phenylethyl)urea	1	benzenes		2017	2017	7.0	low	1
1-(3,5-dichlorophenyl)-3-phenylurea	1	ureas		2017	2017	7.0	medium	1
1-(cyclohexylmethyl)-4-phenylpiperazine	1	piperazines		2017	2017	7.0	medium	1
N-phenethyl-2-furamide	1	aromatic amide; heteroarene		2017	2017	7.0	medium	1
paromomycin sulfate	1			2017	2017	7.0	high	1
N,N,2-trimethyl-1-phenyl-5-benzimidazolesulfonamide	1	benzimidazoles		2017	2017	7.0	medium	1
N-(phenylmethyl)-4-(3-pyridinyl)-2-thiazolamine	1	aralkylamine		2017	2017	7.0	medium	1
N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)benzenesulfonamide	1	monoterpenoid		2017	2017	7.0	medium	1
2-amino-5-ethyl-4-(2-furanyl)-6-propyl-3-pyridinecarbonitrile	1	nitrile; pyridines		2017	2017	7.0	medium	1
2-ethoxy-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]benzamide	1	benzamides		2017	2017	7.0	medium	1
vu0099704	1			2017	2017	7.0	low	1
3-(4-chlorophenyl)-2,5-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one	1	pyrazoles; ring assembly		2017	2017	7.0	medium	1
1-(2-chloro-6-fluorophenyl)-[1,2,4]triazolo[4,3-a]quinoline	1	triazoles		2017	2017	7.0	medium	1
2-methyl-N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)propanamide	1	pyrroloquinoline		2017	2017	7.0	medium	1
2-methyl-5-[(2-methyl-4-quinolinyl)thio]-1,3,4-thiadiazole	1	aryl sulfide		2017	2017	7.0	high	1
5-methyl-1-(4-nitrophenyl)-2-oxo-2,5-dihydro-1h-pyrido(3,2-b)indole-3-carbonitrile	1			2017	2017	7.0	medium	1
(3-hydroxy-5,6,7,8-tetrahydro-4H-cyclohepta[d]imidazol-2-yl)-phenylmethanone	1	aromatic ketone		2017	2017	7.0	medium	1
2-fluoro-N-phenacylbenzamide	1	aromatic ketone		2017	2017	7.0	medium	1
4-(methoxymethyl)-6-methyl-2-(2-methylanilino)-3-pyridinecarbonitrile	1	nitrile; pyridines		2017	2017	7.0	medium	1
1-azepanyl-[2-methoxy-4-(methylthio)phenyl]methanone	1	carbonyl compound; thiol		2017	2017	7.0	medium	1
GS4012 free base	1	aryl sulfide; monomethoxybenzene; pyridines	VEGF activator	2017	2017	7.0	high	1
N-[1-(4-methylphenyl)-5-benzimidazolyl]acetamide	1	benzimidazoles		2017	2017	7.0	medium	1
2-(4-methylanilino)-1-(4-nitrophenyl)ethanone	1	aromatic ketone		2017	2017	7.0	medium	1
N-(2,6-dimethylphenyl)-N(2)-(3,5-dimethylphenyl)glycinamide	1	amino acid amide; glycine derivative		2017	2017	7.0	medium	1
2-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]pyrimidine	1	N-arylpiperazine		2017	2017	7.0	medium	1
1-[(3,4-dimethoxyphenyl)methyl]-4-(2,3-dimethylphenyl)piperazine	1	piperazines		2017	2017	7.0	medium	1
4-Piperidinobenzoic acid	1	piperidines		2017	2017	7.0	medium	1
1-(2-methoxyphenyl)-4-(3-thiophenylmethyl)piperazine	1	piperazines		2017	2017	7.0	medium	1
N-(1-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)-2-(1-pyrrolidinyl)acetamide	1	pyrroloquinoline		2017	2017	7.0	medium	1
4-[(1H-benzimidazol-2-ylthio)methyl]-2-thiazolamine	1	benzimidazoles		2017	2017	7.0	medium	1
4-[(4-phenyl-2-thiazolyl)amino]benzenesulfonamide	1	sulfonamide		2017	2017	7.0	high	1
N-[7-(1-oxopropyl)-2,3-dihydro-1,4-benzodioxin-6-yl]benzamide	1	benzodioxine		2017	2017	7.0	medium	1
N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-2-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
n-(pyridin-2-yl)-4-(pyridin-2-yl)thiazol-2-amine	1			2017	2017	7.0	low	1
8-(3,5-dimethyl-1-pyrazolyl)quinoline	1	quinolines		2017	2017	7.0	medium	1
2'-nitroflavone	1			2017	2017	7.0	low	1
N-(4-methoxyphenyl)-3,4-dihydroquinolin-2-amine	1	aminoquinoline		2017	2017	7.0	medium	1
1-(3-nitrophenyl)-3-phenyl-2-propyn-1-one	1	aromatic compound		2017	2017	7.0	medium	1
vrt 532	1			2017	2017	7.0	low	1
4-[[4-(2,5-dimethylphenyl)-1-piperazinyl]methyl]-2-methoxyphenol	1	piperazines		2017	2017	7.0	medium	1
1-piperonylpiperidine	1			2017	2017	7.0	high	1
2-[(3-fluorophenyl)methyl-(phenylmethyl)amino]ethanol	1	aromatic amine		2017	2017	7.0	medium	1
2-methoxy-4-[[2-(methylthio)anilino]methyl]phenol	1	aromatic amine		2017	2017	7.0	medium	1
6-ethyl-5-methyl-2-thiophen-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one	1	pyrazolopyrimidine		2017	2017	7.0	medium	1
N-[4-(2-methyl-4-thiazolyl)phenyl]benzamide	1	benzamides		2017	2017	7.0	medium	1
N-(6-phenyl-5-imidazo[2,1-b]thiazolyl)benzamide	1	imidazoles		2017	2017	7.0	medium	1
2-(phenylmethylthio)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole	1	aryl sulfide		2017	2017	7.0	medium	1
5-methyl-N-(4,5,6-trimethyl-2-pyrimidinyl)-1,3-benzoxazol-2-amine	1	benzoxazole		2017	2017	7.0	medium	1
1-(4-methoxyphenyl)-3-(6-methyl-2-pyridinyl)urea	1	ureas		2017	2017	7.0	medium	1
2-{[hydroxy(2-methoxyphenyl)methylidene]amino}acetic acid	1	N-acylglycine		2017	2017	7.0	high	1
(4-methoxyphenyl)-(3-methyl-2-propyl-4-imidazolyl)methanone	1	aromatic ketone		2017	2017	7.0	low	1
N-(3-acetamidophenyl)-2-chlorobenzamide	1	benzamides		2017	2017	7.0	medium	1
N4,N4-dimethyl-N1-(4-nitro-1,1-dioxo-2,5-dihydrothiophen-3-yl)benzene-1,4-diamine	1	dialkylarylamine; tertiary amino compound		2017	2017	7.0	medium	1
2-bromo-N-(3-methoxyphenyl)benzamide	1	benzamides		2017	2017	7.0	medium	1
2-methoxy-4-[(4-methyl-1,4-diazepan-1-yl)methyl]-6-nitrophenol	1	aromatic ether; C-nitro compound		2017	2017	7.0	medium	1
3-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]benzoic acid	1	aromatic amide; furans		2017	2017	7.0	medium	1
1-(4-ethoxyphenyl)-3-(6-quinoxalinyl)urea	1	quinoxaline derivative		2017	2017	7.0	medium	1
2-(dimethylsulfamoylamino)-9H-fluorene	1	fluorenes		2017	2017	7.0	medium	1
4-chloro-1-ethyl-3-nitro-2-quinolinone	1	nitro compound; quinolines		2017	2017	7.0	medium	1
4-chloro-3-nitro-1-(phenylmethyl)-2-quinolinone	1	quinolines		2017	2017	7.0	high	1
2,5-dimethyl-1-(phenylmethyl)pyrrole-3,4-dicarboxaldehyde	1	arenecarbaldehyde		2017	2017	7.0	medium	1
2-(2-chloro-6-fluorophenyl)-1-(2,4-dihydroxyphenyl)ethanone	1	stilbenoid		2017	2017	7.0	medium	1
4-methyl-N-(3-nitrophenyl)-5-phenyl-3-thiophenecarboxamide	1	aromatic amide		2017	2017	7.0	medium	1
N-(5-amino-1-phenyl-1,2,4-triazol-3-yl)-2,2,2-trichloroacetamide	1	triazoles		2017	2017	7.0	medium	1
N-(2-fluoro-5-methylphenyl)-3-phenylpropanamide	1	anilide		2017	2017	7.0	medium	1
N-[(4-fluorophenyl)methyl]-2-thiophen-2-ylacetamide	1	organofluorine compound		2017	2017	7.0	medium	1
4-tert-butyl-N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)benzamide	1	phthalazines		2017	2017	7.0	medium	1
N-[2-(2-methylpropyl)-1,3-dioxo-5-isoindolyl]-2-furancarboxamide	1	phthalimides		2017	2017	7.0	medium	1
6-(1,4,5,7-tetramethyl-6-pyrrolo[3,4-d]pyridazinyl)quinoline	1	quinolines		2017	2017	7.0	medium	1
2-(3,4-dimethoxyphenyl)-1-(2,4,6-trihydroxyphenyl)ethanone	1	stilbenoid		2017	2017	7.0	medium	1
5-(3-chloro-4-methylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole	1	oxadiazole; ring assembly		2017	2017	7.0	medium	1
5-(phenylmethyl)-3-(2-pyridinyl)-1,2,4-oxadiazole	1	pyridines		2017	2017	7.0	medium	1
2-methyl-5-(1-pyrrolidinyl)isoindole-1,3-dione	1	phthalimides		2017	2017	7.0	medium	1
(2'-(4-aminophenyl)-(2,5'-bi-1h-benzimidazol)-5-amine)	1	benzimidazoles		2017	2017	7.0	low	1
N-(4-bromo-2-fluorophenyl)-2-methyl-3-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
6,7,8,9-tetrahydro-5H-carbazole-3-carbohydrazide	1	carbazoles		2017	2017	7.0	medium	1
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-pyrazinecarboxamide	1	primary carboxamide; pyrazines; secondary carboxamide		2017	2017	7.0	medium	1
N-(1,3-benzodioxol-5-yl)-5-methyl-2-furancarboxamide	1	benzodioxoles		2017	2017	7.0	medium	1
1-cyclohexyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)urea	1	benzodioxine		2017	2017	7.0	medium	1
8-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)thio]quinoline	1	aryl sulfide		2017	2017	7.0	medium	1
1-[2-(2-chlorophenoxy)ethyl]benzimidazole	1	benzimidazoles		2017	2017	7.0	medium	1
4,5-dimethyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-1H-pyrazol-3-one	1	C-nitro compound		2017	2017	7.0	medium	1
2-(4-fluoro-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide	1	sulfonamide		2017	2017	7.0	medium	1
1-(4-fluorophenyl)-2-(2-pyridinylthio)ethanone	1	aromatic ketone		2017	2017	7.0	medium	1
3-methyl-6-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-b]pyridazine	1	triazolopyridazine		2017	2017	7.0	low	1
N-(3-acetylphenyl)-2-thiophen-2-ylacetamide	1	aromatic ketone		2017	2017	7.0	medium	1
oncrasin-1	1	arenecarbaldehyde; indoles; monochlorobenzenes	antineoplastic agent; apoptosis inducer	2017	2017	7.0	low	1
N-[2-(4-fluorophenyl)ethyl]-4-nitrobenzamide	1	C-nitro compound		2017	2017	7.0	medium	1
5-(1-methyl-2-benzimidazolyl)-2-thiophenecarboxaldehyde	1	benzimidazoles		2017	2017	7.0	medium	1
N-(4-anilinophenyl)-2-methylpropanamide	1	anilide		2017	2017	7.0	medium	1
N-(2-fluorophenyl)-3-phenylpropanamide	1	anilide		2017	2017	7.0	medium	1
1-[(Phenylthio)acetyl]piperidine	1	N-acylpiperidine		2017	2017	7.0	high	1
N-(3-hydroxyphenyl)-5-methyl-3-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
3-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-oxadiazole	1	oxadiazole; ring assembly		2017	2017	7.0	medium	1
4-[(4-carboxy-2,6-dimethoxyphenoxy)methyl]-5-methyl-2-furancarboxylic acid	1	trihydroxybenzoic acid		2017	2017	7.0	low	1
4-(4-morpholinylmethyl)-3-quinolinol	1	quinolines		2017	2017	7.0	medium	1
2-bromo-N-[3-(1-oxopropylamino)phenyl]benzamide	1	benzamides		2017	2017	7.0	low	1
3-acetyl-2-methylbenzo[f]benzofuran-4,9-dione	1	naphthofuran		2017	2017	7.0	medium	1
5-(4-chlorophenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-furancarboxamide	1	aromatic amide; heteroarene		2017	2017	7.0	medium	1
1-azepanyl-[4-[(phenylthio)methyl]phenyl]methanone	1	benzamides		2017	2017	7.0	medium	1
1-(5-ethyl-2,4-dihydroxyphenyl)-2-(2-fluorophenoxy)ethanone	1	aromatic ketone		2017	2017	7.0	medium	1
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-nitrophenyl)acetamide	1	acetamides		2017	2017	7.0	medium	1
3,4,5-triethoxy-N-(1H-1,2,4-triazol-5-yl)benzamide	1	benzamides		2017	2017	7.0	medium	1
1-propylsulfonyl-4-(2-pyridinyl)piperazine	1	piperazines; pyridines		2017	2017	7.0	medium	1
2-(2-phenylethylthio)-3-pyridinecarboxylic acid	1	aromatic carboxylic acid; pyridines		2017	2017	7.0	medium	1
2-(2,3-dimethylphenoxy)-N-pyridin-4-ylacetamide	1	aromatic ether		2017	2017	7.0	medium	1
2-[[anilino(oxo)methyl]amino]-N-(phenylmethyl)benzamide	1	benzamides		2017	2017	7.0	high	1
N-(5-acetyl-4-methyl-2-thiazolyl)-5-bromo-2-furancarboxamide	1	thiazoles		2017	2017	7.0	medium	1
1-cyclohexyl-3-(3-ethylphenyl)urea	1	ureas		2017	2017	7.0	medium	1
n-phenylpiracetam	1			2017	2017	7.0	medium	1
2-[(1-methyl-5-tetrazolyl)thio]-N-(2-phenylphenyl)acetamide	1	biphenyls		2017	2017	7.0	medium	1
N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-2-nitrobenzamide	1	benzamides		2017	2017	7.0	medium	1
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2,6-dimethylphenyl)benzamide	1	isoquinolines		2017	2017	7.0	medium	1
5-(4-bromophenyl)-N-(2-methoxyphenyl)-2-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
3-[[(3,5-dichloro-4-ethoxyphenyl)-oxomethyl]amino]benzoic acid	1	benzamides		2017	2017	7.0	medium	1
1,4-bis(thiophen-2-ylsulfonyl)piperazine	1	N-sulfonylpiperazine; thiophenes		2017	2017	7.0	medium	1
2-bromo-N-[3-(1-oxobutylamino)phenyl]benzamide	1	benzamides		2017	2017	7.0	low	1
1-(2-fluorophenyl)-4-[(6-nitro-1,3-benzodioxol-5-yl)methyl]piperazine	1	piperazines		2017	2017	7.0	medium	1
n-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide	1			2017	2017	7.0	medium	1
2-[[2-(5-methyl-2-thiophenyl)-2-oxoethyl]thio]-3-phenyl-4-quinazolinone	1	quinazolines		2017	2017	7.0	medium	1
1-(2,1,3-benzothiadiazol-5-yl)-3-[4-(4-morpholinyl)phenyl]urea	1	morpholines		2017	2017	7.0	medium	1
ethyl 4-{N-[(4-chlorophenyl)sulfonyl]-N-methylglycyl}piperazine-1-carboxylate	1	carbamate ester; sulfonamide		2017	2017	7.0	medium	1
LSM-4563	1	aromatic ketone		2017	2017	7.0	medium	1
1-(4-chloro-3-methoxyphenyl)sulfonyl-4-phenylpiperazine	1	piperazines		2017	2017	7.0	medium	1
N-[4-[(3,4-dimethoxyphenyl)sulfamoyl]phenyl]acetamide	1	sulfonamide		2017	2017	7.0	medium	1
4-chloro-3-(1-piperidinylsulfonyl)-N-(2-thiazolyl)benzamide	1	sulfonamide		2017	2017	7.0	medium	1
1-(2,5-dimethoxyphenyl)sulfonyl-4-(phenylmethyl)piperazine	1	sulfonamide		2017	2017	7.0	medium	1
2-(4-methoxyphenyl)-N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]acetamide	1	sulfonamide		2017	2017	7.0	medium	1
4-[4-(benzenesulfonyl)-1-piperazinyl]-2-methylquinoline	1	piperazines; pyridines		2017	2017	7.0	medium	1
1-(6-methoxy-2,2,4-trimethyl-1-quinolinyl)-2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone	1	quinolines		2017	2017	7.0	medium	1
N2-phenyl-6-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1,3,5-triazine-2,4-diamine	1	tetrazoles		2017	2017	7.0	medium	1
2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(4,5-diphenyl-2-oxazolyl)acetamide	1	1,3-oxazoles		2017	2017	7.0	medium	1
2-(4-bromophenyl)-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone	1	piperazines; pyridines		2017	2017	7.0	medium	1
2-amino[1,3]thiazolo[4,5-d]pyrimidine-5,7-diol	1	thiazolopyrimidine		2017	2017	7.0	medium	1
3-[[(2-cyclohexyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]benzoic acid	1	aromatic amide		2017	2017	7.0	medium	1
3-[[[3-(1-azepanylsulfonyl)-4-chlorophenyl]-oxomethyl]amino]benzoic acid	1	benzamides		2017	2017	7.0	medium	1
2-(4-bromophenyl)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)acetamide	1	acetamides		2017	2017	7.0	medium	1
5-(1,3-benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid	1	methoxybenzoic acid		2017	2017	7.0	medium	1
N-cycloheptyl-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide	1	sulfonamide		2017	2017	7.0	medium	1
3-(2-chlorophenyl)-5-methyl-N-[4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]-4-isoxazolecarboxamide	1	aromatic amide		2017	2017	7.0	medium	1
N-[3-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]-2-furancarboxamide	1	benzamides		2017	2017	7.0	medium	1
3-methyl-1,5-dithiophen-2-ylpentane-1,5-dione	1	aromatic ketone		2017	2017	7.0	medium	1
N-(2-methyl-1,3-benzothiazol-6-yl)-4-(4-morpholinylsulfonyl)benzamide	1	sulfonamide		2017	2017	7.0	medium	1
4-(dimethylsulfamoyl)-N-(4-thiophen-2-yl-2-thiazolyl)benzamide	1	sulfonamide		2017	2017	7.0	medium	1
3-chloro-N-[4-[(1-oxo-2-phenylethyl)amino]phenyl]benzamide	1	benzamides		2017	2017	7.0	medium	1
N-(3,4-dimethoxyphenyl)-4-[(4-phenyl-1-piperazinyl)methyl]benzamide	1	benzamides		2017	2017	7.0	medium	1
stk295900	1			2017	2017	7.0	medium	1
1-(3-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine	1	piperazines		2017	2017	7.0	medium	1
2-[4-[[4-(4-methoxyphenyl)-1-phthalazinyl]amino]phenyl]acetamide	1	pyridazines; ring assembly		2017	2017	7.0	medium	1
1-(2-fluorophenyl)-3-[5-(2-fluorophenyl)-1,3,4-thiadiazol-2-yl]urea	1	ureas		2017	2017	7.0	medium	1
N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-furancarboxamide	1	methoxybenzenes		2017	2017	7.0	medium	1
N-(1,3-benzodioxol-5-yl)-4-methyl-1-phthalazinamine	1	phthalazines		2017	2017	7.0	medium	1
SMER 28	1	organobromine compound; quinazolines; secondary amino compound	autophagy inducer	2017	2017	7.0	low	1
N-[4-(4-morpholinyl)phenyl]carbamic acid butyl ester	1	morpholines		2017	2017	7.0	low	1
4-(4-chlorophenoxy)-1-(4-morpholinyl)-1-butanone	1	aromatic ether		2017	2017	7.0	medium	1
4-(4-chlorophenoxy)-1-(1-piperidinyl)-1-butanone	1	N-acylpiperidine		2017	2017	7.0	medium	1
N-(3-phenylpropyl)methanesulfonamide	1	benzenes		2017	2017	7.0	medium	1
4-acetamido-N-(2-methoxyethyl)benzamide	1	amidobenzoic acid		2017	2017	7.0	medium	1
2-methyl-N-(2,3,4,5,6-pentafluorophenyl)-3-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
3,4-dihydro-2H-quinolin-1-yl-(4-propoxyphenyl)methanone	1	quinolines		2017	2017	7.0	medium	1
5-bromo-N-(2-phenylphenyl)-2-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
2-[2-(4-chlorophenoxy)ethylthio]pyrimidine	1	aromatic ether		2017	2017	7.0	medium	1
3-(3-bromoanilino)-1-(5-methyl-2-furanyl)-1-propanone	1	aralkylamine		2017	2017	7.0	medium	1
4-[2-(4-bromo-2-chlorophenoxy)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester	1	piperazinecarboxylic acid		2017	2017	7.0	medium	1
2-[2-[[3-(1,3-benzoxazol-2-yl)anilino]-oxomethyl]phenyl]benzoic acid	1	benzamides		2017	2017	7.0	medium	1
1-[2-(2-chlorophenoxy)ethoxy]-2-methoxy-4-methylbenzene	1	methoxybenzenes		2017	2017	7.0	medium	1
N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl]cyclopropanecarboxamide	1	sulfonamide		2017	2017	7.0	medium	1
4-[2-[2-(4-bromo-2-chlorophenoxy)ethoxy]ethyl]morpholine	1	aromatic ether		2017	2017	7.0	medium	1
N-[2-(2-phenylphenoxy)ethyl]-2-furancarboxamide	1	biphenyls		2017	2017	7.0	medium	1
5,6,7,8-tetrafluoro-2-(2,3,4,5,6-pentafluorophenyl)-4h-1-benzopyran-4-one	1			2017	2017	7.0	medium	1
2-[bis(5-methyl-2-furanyl)methyl]-6-nitrophenol	1	nitrophenol		2017	2017	7.0	medium	1
2-(4-nitrophenyl)-N-(2-oxolanylmethyl)-4-quinazolinamine	1	quinazolines		2017	2017	7.0	medium	1
2-(4-hydroxy-1,3-thiazol-2-yl)-1-phenylethan-1-one	1	aromatic ketone		2017	2017	7.0	medium	1
Methyl(2-furoylamino)acetic acid	1	N-acyl-amino acid		2017	2017	7.0	medium	1
5-nitro-8-(1-pyrrolidinyl)quinoline	1	nitro compound; quinolines		2017	2017	7.0	medium	1
2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-phenylacetamide	1	amino acid amide		2017	2017	7.0	medium	1
2-[(4-methylphenyl)sulfonylamino]pentanoic acid	1	sulfonamide		2017	2017	7.0	medium	1
4,6-dimorpholino-n-(4-nitrophenyl)-1,3,5-triazin-2-amine	1			2017	2017	7.0	low	1
1-[(3-chlorophenyl)methyl]-N,N-diethyl-3-piperidinecarboxamide	1	piperidines		2017	2017	7.0	medium	1
1-(2,6-dimethyl-1-piperidinyl)-2-phenylethanone	1	acetamides		2017	2017	7.0	medium	1
2-amino-7-methyl-5-oxo-4-(2,3,4-trimethoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile	1	methoxybenzenes		2017	2017	7.0	medium	1
3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-phenylpyrrolidine-2,5-dione	1	pyrrolidines		2017	2017	7.0	medium	1
1-(4-bromophenyl)-3-(diethylamino)pyrrolidine-2,5-dione	1	pyrrolidines		2017	2017	7.0	medium	1
4-(5,6-diphenyl-1,2,4-triazin-3-yl)morpholine	1	dialkylarylamine; tertiary amino compound		2017	2017	7.0	medium	1
(3,5-Dimethyl-1-adamantyl)amine nitrate	1	nitrates		2017	2017	7.0	medium	1
1-(4-tert-butylphenoxy)-3-(1H-1,2,4-triazol-5-ylthio)-2-propanol	1	alkylbenzene		2017	2017	7.0	medium	1
N-[2-(1-methyl-2-pyrrolidinyl)ethyl]-2-adamantanamine	1	N-alkylpyrrolidine		2017	2017	7.0	medium	1
4-phenyl-N-(pyridin-4-ylmethyl)-2-butanamine	1	aralkylamine		2017	2017	7.0	medium	1
N-(5-nitro-2-pyridinyl)cyclopropanecarboxamide	1	aromatic amide		2017	2017	7.0	medium	1
3-[(4-bromophenyl)methyl]-4-(4-methoxyanilino)-4-oxobutanoic acid	1	anilide		2017	2017	7.0	medium	1
3-ethyl-N-(2H-tetrazol-5-yl)-1-adamantanecarboxamide	1	aromatic amide		2017	2017	7.0	medium	1
N-(4-propan-2-ylphenyl)-3-bicyclo[2.2.1]heptanecarboxamide	1	monoterpenoid		2017	2017	7.0	medium	1
4-chloro-N-[2-(4-nitroanilino)ethyl]benzamide	1	carbonyl compound; organohalogen compound		2017	2017	7.0	medium	1
2-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-1-cyclohexanecarboxylic acid	1	benzodioxine		2017	2017	7.0	medium	1
2,4-dichloro-6-[1-(4-morpholinyl)-3-phenylprop-2-ynyl]phenol	1	aromatic compound		2017	2017	7.0	medium	1
2-[[1-(4-ethoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]amino]acetonitrile	1	pyrrolidines		2017	2017	7.0	medium	1
1-ethoxy-3-(2-methoxy-4-prop-2-enylphenoxy)-2-propanol	1	methoxybenzenes		2017	2017	7.0	medium	1
6-amino-4-(3-chlorophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile	1	organochlorine compound; pyranopyrazole		2017	2017	7.0	medium	1
1-(2-chlorophenoxy)-3-(2-methyl-1-benzimidazolyl)-2-propanol	1	benzimidazoles		2017	2017	7.0	medium	1
N-[2-furanyl-(8-hydroxy-7-quinolinyl)methyl]-2-methylpropanamide	1	hydroxyquinoline		2017	2017	7.0	medium	1
N-(2-hydroxy-5-methylphenyl)-2-furancarboxamide	1	aromatic amide; furans		2017	2017	7.0	medium	1
4-amino-7,8,9,10-tetrahydro-6H-pyrimido[3,4]pyrrolo[3,5-a]azepine-11-carbonitrile	1	organic heterobicyclic compound; organonitrogen heterocyclic compound		2017	2017	7.0	medium	1
1-(3,5-dimethylphenyl)-3-(1H-1,2,4-triazol-5-ylthio)pyrrolidine-2,5-dione	1	pyrrolidines		2017	2017	7.0	medium	1
6-[(3,4-difluoroanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid	1	anilide		2017	2017	7.0	medium	1
4-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-4-oxobutanoic acid	1	organosulfur heterocyclic compound		2017	2017	7.0	medium	1
[3-methyl-4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-thiophen-2-ylmethanone	1	aromatic amide; thiophenes		2017	2017	7.0	medium	1
[4-(2-methoxyphenyl)-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone	1	piperazines		2017	2017	7.0	medium	1
N-(3,3,5-trimethylcyclohexyl)-1H-1,2,4-triazole-5-carboxamide	1	aromatic amide; heteroarene		2017	2017	7.0	medium	1
4-[2-nitro-5-[4-(phenylmethyl)sulfonyl-1-piperazinyl]phenyl]morpholine	1	piperazines		2017	2017	7.0	medium	1
5-(4-ethylsulfonyl-1-piperazinyl)-2-nitro-N-(3-pyridinylmethyl)aniline	1	piperazines		2017	2017	7.0	medium	1
2-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-[2-(4-morpholinyl)ethyl]acetamide	1	benzothiazoles		2017	2017	7.0	medium	1
N-ethyl-N-[2-[(5-nitro-8-quinolinyl)amino]ethyl]benzenesulfonamide	1	nitro compound; quinolines		2017	2017	7.0	medium	1
1-(4-methoxyphenyl)-N-(4-methyl-2-pyridinyl)-5-oxo-3-pyrrolidinecarboxamide	1	pyrrolidines		2017	2017	7.0	medium	1
3,4,5-trimethoxy-N-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]benzamide	1	benzamides		2017	2017	7.0	medium	1
3-(n,n-dimethylsulfonamido)-4-methyl-nitrobenzene	1	C-nitro compound; sulfonamide; toluenes	bone density conservation agent; EC 3.1.4.53 (3',5'-cyclic-AMP phosphodiesterase) inhibitor; geroprotector	2017	2017	7.0	low	1
6,3',4'-Trimethoxyflavanone	1	ether; flavonoids		2017	2017	7.0	low	1
1-[4-(3-ethoxyphenoxy)butyl]imidazole	1	aromatic ether		2017	2017	7.0	medium	1
5-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-3-phenyl-1,2,4-oxadiazole	1	oxadiazole; ring assembly		2017	2017	7.0	medium	1
2-[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]isoindole-1,3-dione	1	phthalimides		2017	2017	7.0	medium	1
[4-(benzenesulfonyl)-1-piperazinyl]-(1-piperidinyl)methanone	1	sulfonamide		2017	2017	7.0	high	1
3-(2,5-dioxo-1-pyrrolidinyl)-N-(2-methyl-1,3-dioxo-5-isoindolyl)benzamide	1	amidobenzoic acid		2017	2017	7.0	medium	1
6-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid	1	aromatic amide		2017	2017	7.0	medium	1
2,5-dimethoxy-n-(quinolin-3-yl)benzenesulfonamide	1	quinolines		2017	2017	7.0	medium	1
LSM-25805	1	isoindoles		2017	2017	7.0	medium	1
4-ethoxy-N-(3-quinolinyl)benzenesulfonamide	1	quinolines		2017	2017	7.0	medium	1
3-chloro-N-[3-(1-imidazolyl)propyl]-6-nitro-1-benzothiophene-2-carboxamide	1	1-benzothiophenes		2017	2017	7.0	medium	1
nsc 727447	1			2017	2017	7.0	low	1
2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide	1	acetamides		2017	2017	7.0	medium	1
2-(4-chlorophenoxy)-N-(5-nitro-2-thiazolyl)acetamide	1	C-nitro compound; thiazoles		2017	2017	7.0	medium	1
7-(2-methoxyphenyl)-5-phenyl-1,7-dihydrotetrazolo[1,5-a]pyrimidine	1	methoxybenzenes		2017	2017	7.0	medium	1
N-[3-[2,5-dioxo-3-(phenylmethyl)-1-pyrrolidinyl]phenyl]acetamide	1	pyrrolidines		2017	2017	7.0	medium	1
3,4-dimethoxy-N-[3-(methylthio)phenyl]benzenesulfonamide	1	sulfonamide		2017	2017	7.0	medium	1
2-[(4-chlorophenyl)methylthio]-N-(2-hydroxy-5-nitrophenyl)acetamide	1	nitrophenol		2017	2017	7.0	medium	1
2-(4-ethoxyphenyl)-N-[3-(1-imidazolyl)propyl]-4-quinolinecarboxamide	1	quinolines		2017	2017	7.0	medium	1
N-(4-bromophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine	1	C-nitro compound		2017	2017	7.0	medium	1
3,3-bis(4-hydroxyphenyl)-7-methyl-1,3-dihydro-2h-indol-2-one	1			2017	2017	7.0	low	1
N-[4-[(cyclohexylamino)-oxomethyl]phenyl]-3-pyridinecarboxamide	1	aromatic amide		2017	2017	7.0	medium	1
N,N,4-trimethyl-2-[[(5-methyl-2-furanyl)-oxomethyl]amino]-5-thiazolecarboxamide	1	aromatic amide; thiazoles		2017	2017	7.0	medium	1
ex 527	1	carbazoles; monocarboxylic acid amide; organochlorine compound		2017	2017	7.0	low	1
3-[3-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]propyl]-1H-benzimidazol-2-one	1	indoles		2017	2017	7.0	medium	1
4-methyl-2,7-diphenyl-8H-pyrido[2,3-d]pyrimidin-5-one	1	phenylpyridine		2017	2017	7.0	medium	1
3-methylharman	1			2017	2017	7.0	medium	1
1-methyl-beta-carboline-3-carboxylic acid	1			2017	2017	7.0	low	1
sildenafil	1	piperazines; pyrazolopyrimidine; sulfonamide	EC 3.1.4.35 (3',5'-cyclic-GMP phosphodiesterase) inhibitor; vasodilator agent	2017	2017	7.0	low	1
2-methyl-4(3h)-quinazolinone	1			2017	2017	7.0	low	1
n(4)-desoxychlordiazepoxide	1			2017	2017	7.0	high	1
2-amino-3-hydroxyphenazine	1			2017	2017	7.0	medium	1
2-styrylquinazolin-4(3h)-one	1			2017	2017	7.0	low	1
2-amino-5-iodo-6-phenyl-4-pyrimidinone	1			2017	2017	7.0	low	1
quininib	1	phenols; styrylquinoline	angiogenesis inhibitor	2017	2017	7.0	low	1
bropirimine	1	pyrimidines		2017	2017	7.0	low	1
2-[(6-ethyl-4-methyl-2-quinazolinyl)amino]-1H-quinazolin-4-one	1	quinazolines		2017	2017	7.0	high	1
2-[(6-ethyl-4-methyl-2-quinazolinyl)amino]-6-(methoxymethyl)-1H-pyrimidin-4-one	1	quinazolines		2017	2017	7.0	medium	1

Condition	Studies	First Year	Last Year	Average Age	Relationship Strength	2000's	2010's
Inflammation	1	2010	2010	14.0	high	1	0
Innate Inflammatory Response	1	2010	2010	14.0	high	1	0
Malaria, Falciparum	1	2014	2014	10.0	high	0	1
Plasmodium falciparum Malaria	1	2014	2014	10.0	high	0	1

3-methyl-4-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide

Description

Cross-References

Synonyms (26)

Drug Classes (1)

Protein Targets (8)

Potency Measurements

Activation Measurements

Bioassays (9)

Research

Studies (8)

Study Types

Related Drugs (805)

Drugs in this Class (271)

Drugs Involved in Assays Together (547)

Related Conditions (4)