CID int64 19 167M | SID int64 842k 144M | IUPAC_Name stringlengths 6 1.03k ⌀ | PAIN_flag stringclasses 2
values |
|---|---|---|---|
2,810,149 | 26,731,670 | 2-chloro-4-fluoro-N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide | No |
2,739,359 | 26,731,671 | 4-(thiadiazol-4-yl)benzamide | No |
2,732,654 | 26,731,672 | 3-(2-aminophenyl)sulfanyl-1-(5-chloro-2-methoxyphenyl)pyrrolidine-2,5-dione | No |
2,746,653 | 26,731,673 | 5-benzylsulfanyl-2-pyridin-2-yl-2,3-dihydro-1,3,4-thiadiazole | No |
2,731,590 | 26,731,674 | 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-sulfanylidene-1H-quinazolin-4-one | No |
2,803,323 | 26,731,679 | 1-[[4-(dimethylamino)benzoyl]amino]-3-methylthiourea | No |
2,803,659 | 26,731,680 | 1-(4-methoxyphenyl)-3-(3-methoxypropylcarbamothioylamino)thiourea | No |
2,811,802 | 26,731,681 | N-[2-(2,4-dichlorophenoxy)phenyl]-2-(2-oxo-[1,3]oxazolo[4,5-b]pyridin-3-yl)acetamide | No |
2,812,864 | 26,731,682 | 1-(2-ethoxyphenyl)-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazine | No |
2,813,702 | 26,731,684 | 1-(4-chlorophenyl)-3-[[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]urea | No |
9,583,772 | 26,731,685 | 5-amino-1-phenyl-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]pyrazole-4-carboxamide | No |
5,713,372 | 26,731,687 | (3Z)-3-[2-(1,3-benzodioxol-5-yl)-2-oxoethylidene]-5-bromo-1H-indol-2-one | No |
2,744,120 | 26,731,689 | N-(3-chlorophenyl)-2-[[2-(4-chlorophenyl)-6-oxo-1H-1,3,5-triazin-4-yl]sulfanyl]acetamide | No |
2,810,062 | 26,731,691 | N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)furan-2-carboxamide | No |
2,817,019 | 26,731,694 | 2-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-sulfamoylphenyl)acetamide | No |
224,406 | 26,731,695 | 5,8-dimethoxy-4-oxo-1H-quinoline-2-carboxylic acid | No |
2,801,256 | 26,731,696 | 6-methyl-5-(2-methyl-1,3-thiazol-4-yl)-2-oxo-1H-pyridine-3-carbonitrile | No |
2,746,662 | 26,731,697 | N-(3-chlorophenyl)-2-[(2-pyridin-2-yl-2,3-dihydro-1,3,4-thiadiazol-5-yl)sulfanyl]acetamide | No |
2,729,981 | 26,731,698 | 2-N-(3-chloro-4-fluorophenyl)-1,3,5-triazine-2,4-diamine | No |
2,775,269 | 26,731,700 | 1,3,6,7-tetrahydro-[1,4]dioxino[2,3-f]benzimidazole-2-thione | No |
2,801,913 | 26,731,702 | 2-[(7-methyl-[1,2,4]triazolo[3,4-c][1,2,4]benzotriazin-1-yl)sulfanyl]acetic acid | No |
2,813,548 | 26,731,703 | methyl 3-[[2-[1-[(4-butylphenyl)carbamoyl]-3-oxopiperazin-2-yl]acetyl]amino]thiophene-2-carboxylate | No |
2,816,558 | 26,731,704 | 4-amino-2-(2,4-dimethoxyanilino)pyrimidine-5-carbonitrile | No |
2,799,650 | 26,731,706 | 3-[(4-chlorophenyl)sulfanylmethyl]-1,4-dihydropyrazol-5-one | No |
2,743,161 | 26,731,707 | [[3,5-bis(trifluoromethyl)benzoyl]amino]thiourea | No |
54,684,636 | 26,731,708 | 2,6-dihydroxy-3,7-bis(methoxycarbonyl)bicyclo[3.3.1]nona-2,6-diene-1,5-dicarboxylic acid | No |
2,725,676 | 26,731,709 | 6-methyl-5-[(4-methylphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one | No |
135,419,062 | 26,731,711 | 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-oxo-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile | PAIN |
2,730,424 | 26,731,712 | 2-[5-[3,5-bis(trifluoromethyl)phenyl]tetrazol-2-yl]-N'-methylsulfonylacetohydrazide | No |
2,810,398 | 26,731,713 | 5-[4-(6-chloro-1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]-3,3-dimethyl-5-oxopentanoic acid | No |
2,807,234 | 26,731,714 | 4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrobenzenesulfonamide | No |
2,807,459 | 26,731,715 | 4-(2-hydroxyphenyl)-8,9-dimethyl-1,3-dihydro-1,5-benzodiazepin-2-one | No |
5,903,252 | 26,731,716 | (E)-4-[[4-[[[(E)-3-carboxyprop-2-enoyl]amino]methyl]cyclohexyl]methylamino]-4-oxobut-2-enoic acid | No |
2,808,279 | 26,731,718 | 2-(7-methylthieno[3,2-d]pyrimidin-4-yl)sulfanyl-N'-[3-(trifluoromethyl)phenyl]sulfonylacetohydrazide | No |
2,804,805 | 26,731,720 | 2,6-bis(2-hydroxyethylamino)-3-nitrobenzonitrile | No |
5,713,872 | 26,731,721 | (E)-N,N'-bis(thiophen-2-ylmethyl)but-2-enediamide | No |
3,721,614 | 26,731,722 | N'-(2-amino-5-nitrobenzoyl)furan-2-carbohydrazide | No |
2,812,981 | 26,731,723 | 4-methyl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]benzenesulfonamide | No |
2,813,176 | 26,731,724 | 5-(2-methyl-1,3-thiazol-4-yl)-N-(3-sulfamoylphenyl)thiophene-2-sulfonamide | No |
2,813,280 | 26,731,725 | 5-benzyl-11-phenyl-1,5,8,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),8,10-triene-2,6-dione | No |
2,825,947 | 26,731,726 | 2-[2-oxo-2-(pyridin-2-ylamino)ethyl]sulfanylacetic acid | No |
2,806,315 | 26,731,727 | N-[[4-(1,3-oxazol-5-yl)phenyl]carbamoyl]-4-(trifluoromethyl)benzamide | No |
2,816,172 | 26,731,728 | ethyl 5-[3-(trifluoromethyl)anilino]triazolo[1,5-a]quinazoline-3-carboxylate | No |
2,726,558 | 26,731,729 | 5-(4-chloroanilino)-3-oxo-1,2-thiazole-4-carbonitrile | No |
2,744,059 | 26,731,730 | 1-[(2-methyl-1,3-thiazole-4-carbonyl)amino]-3-phenylurea | No |
2,800,776 | 26,731,731 | 4-(2-aminoanilino)-1-[(4-chlorophenyl)methyl]-2-oxopyrimidine-5-carbonitrile | No |
9,580,907 | 26,731,733 | [(Z)-[amino(1,2-oxazol-5-yl)methylidene]amino] N-[3-(trifluoromethyl)phenyl]carbamate | No |
2,795,860 | 26,731,734 | N-(3-chloro-2-methylphenyl)-4-(5-nitro-2-pyridinyl)piperazine-1-carbothioamide | No |
2,739,786 | 26,731,735 | 2,6-dimethyl-4-thiophen-3-ylpyridine-3,5-dicarboxylic acid | No |
2,818,527 | 26,731,737 | 6-(4-chlorophenyl)-4-[(2-chlorophenyl)methylsulfanyl]-1H-1,3,5-triazin-2-one | No |
2,814,553 | 26,731,739 | 1-(3-chlorophenyl)-3-[(2-phenothiazin-10-ylacetyl)amino]urea | No |
135,520,577 | 26,731,740 | N-[(E)-(3,5-dibromo-2-hydroxyphenyl)methylideneamino]-4-(dimethylamino)benzamide | PAIN |
2,814,130 | 26,731,747 | 2-[2-[[6-(7-chloroquinazolin-4-yl)oxy-3-pyridinyl]amino]-2-oxoethoxy]acetic acid | No |
2,813,937 | 26,731,748 | N-[4-[(4-fluorophenyl)carbamoylamino]phenyl]-2-hydroxybenzamide | No |
135,520,619 | 26,731,771 | [(E)-1-(3,5-dichloro-2-hydroxyphenyl)ethylideneamino]urea | PAIN |
2,814,075 | 26,731,778 | N-[4-[(2,4-difluorophenyl)carbamoylamino]phenyl]-2-hydroxybenzamide | No |
227,307 | 26,731,794 | N-[2-(methanesulfonamido)phenyl]methanesulfonamide | No |
2,813,284 | 26,731,795 | 5-benzyl-11-(furan-2-yl)-1,5,8,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),8,10-triene-2,6-dione | No |
135,520,597 | 26,731,796 | 1-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-3-(8-tricyclo[5.2.1.02,6]dec-4-enyl)thiourea | PAIN |
2,803,710 | 26,731,797 | 1-amino-3-(4-piperidin-1-ylsulfonylphenyl)thiourea | No |
3,490,678 | 26,731,798 | 1-hydroxy-4-nitroanthracene-9,10-dione | PAIN |
306,924 | 26,731,799 | 1-phenyl-3-(4-sulfamoylphenyl)urea | No |
310,649 | 26,731,800 | 1-(3-methylphenyl)-3-(4-sulfamoylphenyl)urea | No |
5,714,656 | 26,731,801 | 4-cyclopropyl-3-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one | No |
2,814,129 | 26,731,802 | 4-[[6-(7-chloroquinazolin-4-yl)oxy-3-pyridinyl]amino]-4-oxobutanoic acid | No |
2,814,525 | 26,731,811 | N-(4-sulfamoylphenyl)quinoxaline-6-carboxamide | No |
2,814,498 | 26,731,812 | 2-hydroxy-N-[4-(trifluoromethyl)benzoyl]benzamide | No |
2,803,962 | 26,731,813 | 2-(2-hydroxyphenyl)-6-methylsulfanyl-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile | PAIN |
2,809,649 | 26,731,815 | 5-morpholin-4-ylsulfonyl-N-(4-sulfamoylphenyl)furan-2-carboxamide | No |
2,813,527 | 26,731,818 | N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]thiophene-3-sulfonamide | No |
16,060,479 | 26,732,348 | (3R,3aR,7aR)-2-benzyl-3-[4-[4-(dimethylamino)phenyl]-2-fluorophenyl]-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one | No |
269,609 | 26,732,549 | (4-methyl-2-oxochromen-7-yl) methanesulfonate | No |
12,446 | 26,732,556 | diethyl 2,4,6-trimethyl-1,4-dihydropyridine-3,5-dicarboxylate | No |
4,132,952 | 26,732,563 | 6-(6-aminopurin-9-yl)-2-ethoxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol | No |
282,395 | 26,732,574 | (1-tert-butylazetidin-2-yl)methanamine | No |
378,581 | 26,732,578 | 8,11-dimethylbenzo[a]carbazole-1,4-dione | PAIN |
8,737 | 26,732,621 | 2-aminopentanedioic acid;hydrochloride | No |
25,246,345 | 57,655,023 | N-[4-[[5-(6-acetamido-3-benzyl-4-oxo-1,2-dihydroquinazolin-2-yl)-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,346 | 57,655,024 | N-[4-[[5-[6-acetamido-3-[(3-chlorophenyl)methyl]-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,347 | 57,655,025 | [2-[[2-[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]-3-benzyl-4-oxo-1,2-dihydroquinazolin-6-yl]amino]-2-oxoethyl] acetate | No |
25,246,348 | 57,655,026 | N-[2-[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]-3-[(3-chlorophenyl)methyl]-4-oxo-1,2-dihydroquinazolin-6-yl]-2-hydroxyacetamide | No |
25,246,349 | 57,655,027 | N-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methyl]-N-benzyl-4-methoxybenzamide | No |
25,246,352 | 57,655,030 | N-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methyl]-N-benzylcyclopropanecarboxamide | No |
25,246,353 | 57,655,031 | N-[2-[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]-3-[(3-chlorophenyl)methyl]-4-oxoquinazolin-6-yl]-2-hydroxyacetamide | No |
25,246,354 | 57,655,032 | N-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methyl]-N-benzylpyridine-4-carboxamide | No |
25,246,355 | 57,655,033 | N-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methyl]-N-benzyl-3-cyanobenzamide | No |
25,246,364 | 57,655,043 | 2-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methylamino]-N-benzylbenzamide | No |
25,246,365 | 57,655,044 | N-[4-[[5-[6-acetamido-3-[(3-chlorophenyl)methyl]-4-oxoquinazolin-2-yl]-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,376 | 57,655,055 | N-[4-[[5-[[benzyl(phenylcarbamoyl)amino]methyl]-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,378 | 57,655,058 | N-[4-[[5-[(benzylamino)methyl]-2-methoxyphenyl]methoxy]phenyl]acetamide | PAIN |
25,246,379 | 57,655,059 | N-[4-[[5-[[acetyl(benzyl)amino]methyl]-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,380 | 57,655,060 | N-[4-[[5-[(2,4-dioxo-3,5-diphenylimidazolidin-1-yl)methyl]-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,381 | 57,655,061 | N-[4-[[5-(6-acetamido-3-benzyl-4-oxoquinazolin-2-yl)-2-methoxyphenyl]methoxy]phenyl]acetamide | No |
25,246,382 | 57,655,062 | [2-[[2-[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]-3-benzyl-4-oxoquinazolin-6-yl]amino]-2-oxoethyl] acetate | No |
25,246,385 | 57,655,065 | N-[[3-[(4-acetamidophenoxy)methyl]-4-methoxyphenyl]methyl]-N-benzyl-2-(4-methylpiperazin-1-yl)acetamide | No |
1,013,376 | 144,206,362 | N-[(4-acetamidophenyl)carbamothioyl]-4-tert-butylbenzamide | No |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.