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中文名称 英文名称 CAS号 化学式 结构式图片
—— 1-(methyl((S)-3-(naphthalen-1-yloxy)-3-(thiophen-2-yl)propyl)carbamoyloxy)ethyl 2-((S)-2,3-bis(nitrooxy)propoxy)acetate 1321459-09-9 C26H30N2O8S
1-(methyl((S)-3-(naphthalen-1-yloxy)-3-(thiophen-2-yl)propyl)carbamoyloxy)ethyl 2-((S)-2,3-bis(nitrooxy)propoxy)acetate
—— 4-{[3-(4-dimethylaminophenylsulfamoyl)benzenesulfonylamino]methyl}piperidine-1-carboxylic acid tert-butyl ester 1332527-74-8 C25H36N4O6S2
4-{[3-(4-dimethylaminophenylsulfamoyl)benzenesulfonylamino]methyl}piperidine-1-carboxylic acid tert-butyl ester
—— 2-(1-((4-morpholino-2-(2-(trifluoromethyl)-1H-benzo[d]imidazol-1-yl)pyrido[3,2-d]pyrimidin-6-yl)methyl)piperidin-4-yl)propan-2-ol 1332076-48-8 C28H32F3N7O2
2-(1-((4-morpholino-2-(2-(trifluoromethyl)-1H-benzo[d]imidazol-1-yl)pyrido[3,2-d]pyrimidin-6-yl)methyl)piperidin-4-yl)propan-2-ol
—— 4-(adamantan-2-ylaminomethyl)benzene-1,2-diol 1152823-23-8 C17H23NO2
4-(adamantan-2-ylaminomethyl)benzene-1,2-diol
—— bimatoprost analogue d2 1219032-06-0 C25H35NO4
bimatoprost analogue d2
—— 3-({5-[3-(aminomethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidin-4-yI}amino)-N-methylbenzenesulfonamide 1351090-69-1 C20H20N6O2S
3-({5-[3-(aminomethyl)phenyl]-1H-pyrrolo[2,3-d]pyrimidin-4-yI}amino)-N-methylbenzenesulfonamide
—— N-methyl-N-methoxy-2-nitro-5-(2'-chloro-4'-trifluoromethylphenoxy)phenylacetoxyacetamide 101244-02-4 C19H16ClF3N2O7
N-methyl-N-methoxy-2-nitro-5-(2'-chloro-4'-trifluoromethylphenoxy)phenylacetoxyacetamide
—— 5-{5-[(4-acetylpiperazin-1-yl)methyl]pyridin-3-yl}-1-[(2,2-difluorocyclopropyl)methyl]-3-methyl-1,3-dihydro-2,1,3-benzothiadiazole 2,2-dioxide 1333263-78-7 C23H27F2N5O3S
5-{5-[(4-acetylpiperazin-1-yl)methyl]pyridin-3-yl}-1-[(2,2-difluorocyclopropyl)methyl]-3-methyl-1,3-dihydro-2,1,3-benzothiadiazole 2,2-dioxide
—— 2-{6-(4-chloro-phenyl)-2-[1-(3-methyl-[1,2,4]thiadiazol-5-yl)-piperidin-4-ylamino]-pyrimidin-4-yl}-propan-2-ol 1329669-64-8 C21H25ClN6OS
2-{6-(4-chloro-phenyl)-2-[1-(3-methyl-[1,2,4]thiadiazol-5-yl)-piperidin-4-ylamino]-pyrimidin-4-yl}-propan-2-ol
—— N-(2-acetamidoethyl)-4-[(11β,17β)-17-hydroxy-3-oxo-17-(pentafluoroethyl)estra-4,9-dien-11-yl]benzamide 1325225-16-8 C31H35F5N2O4
N-(2-acetamidoethyl)-4-[(11β,17β)-17-hydroxy-3-oxo-17-(pentafluoroethyl)estra-4,9-dien-11-yl]benzamide
—— (S)-pentan-2-yl 2-methoxy-4-(8-methyl-3-morpholinoimidazo[1,5-a]pyrazin-1-yl)phenylcarbamate 1326279-98-4 C24H31N5O4
(S)-pentan-2-yl 2-methoxy-4-(8-methyl-3-morpholinoimidazo[1,5-a]pyrazin-1-yl)phenylcarbamate
—— 3-(4-{2-[2-(3,3-difluoro-azetidin-1-yl)-2-oxo-ethyl]-6H-1,3,5,6-tetraaza-as-indacen-1-yl}-piperidin-1-yl)-propionitrile 1315486-66-8 C21H23F2N7O
3-(4-{2-[2-(3,3-difluoro-azetidin-1-yl)-2-oxo-ethyl]-6H-1,3,5,6-tetraaza-as-indacen-1-yl}-piperidin-1-yl)-propionitrile
—— 3-((6-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)oxy)-N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-4-methylbenzamide 1315330-15-4 C29H29ClF3N5O2
3-((6-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)oxy)-N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-4-methylbenzamide
—— 6-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-(2-hydroxyethyl)-4H-[1,2,4]triazolo[5,1-b]pyrimidin-7-one 1335026-73-7 C15H12F4N4O2
6-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-(2-hydroxyethyl)-4H-[1,2,4]triazolo[5,1-b]pyrimidin-7-one
—— 6-amino-2-(butyloxy)-9-{5-[1-(2-hydroxyethyl)-4-piperidinyl]pentyl}-7,9-dihydro-8H-purin-8-one 1325232-18-5 C21H36N6O3
6-amino-2-(butyloxy)-9-{5-[1-(2-hydroxyethyl)-4-piperidinyl]pentyl}-7,9-dihydro-8H-purin-8-one
—— 4-{[2-(2-fluorophenyl)-3-oxo-1,2,3,4,6,7-hexahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methyl}benzonitrile 1331733-14-2 C20H17FN4O
4-{[2-(2-fluorophenyl)-3-oxo-1,2,3,4,6,7-hexahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methyl}benzonitrile
—— methyl N-[(1R)-2-[(2S)-2-[6-[4-[2-[(2S)-1-[(2R)-2-(methoxycarbonylamino)-2-phenylacetyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]-2,5-dioxopiperazin-1-yl]-1H-benzimidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate 1239653-06-5 C46H46N10O8
methyl N-[(1R)-2-[(2S)-2-[6-[4-[2-[(2S)-1-[(2R)-2-(methoxycarbonylamino)-2-phenylacetyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]-2,5-dioxopiperazin-1-yl]-1H-benzimidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate
—— (3aS,4S,9aS,9bS)-6-methyl-2-oxo-2,3,3a,4,5,7,8,9,9a,9b-decahydrobenzo[de]chromen-4-yl acetate 1294513-64-6 C15H20O4
(3aS,4S,9aS,9bS)-6-methyl-2-oxo-2,3,3a,4,5,7,8,9,9a,9b-decahydrobenzo[de]chromen-4-yl acetate
—— 5-(5-(1-(1,6-naphthyridin-2-yl)cyclopropylcarbamoyl)-2-methylphenyl)-4-fluoro-2-(4-fluorophenyl)-N-methylbenzofuran-3-carboxamide 1334142-48-1 C35H26F2N4O3
5-(5-(1-(1,6-naphthyridin-2-yl)cyclopropylcarbamoyl)-2-methylphenyl)-4-fluoro-2-(4-fluorophenyl)-N-methylbenzofuran-3-carboxamide
—— 2-Brom-4,5-methylendioxy-α-acetylmercapto-toluol 116532-30-0 C10H9BrO3S
2-Brom-4,5-methylendioxy-α-acetylmercapto-toluol
—— 1-(4-{4-[7-amino-2-(biphenyl-3-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}piperidin-1-yl)ethanone 1326710-20-6 C29H27N5O2
1-(4-{4-[7-amino-2-(biphenyl-3-yl)furo[2,3-c]pyridin-4-yl]-1H-pyrazol-1-yl}piperidin-1-yl)ethanone
—— 2-({[5-(biphenyl-4-yl)-6-chloro-1H-benzimidazol-2-yl]oxy}methyl)cyclopropane carboxylic acid 1332706-75-8 C24H19ClN2O3
2-({[5-(biphenyl-4-yl)-6-chloro-1H-benzimidazol-2-yl]oxy}methyl)cyclopropane carboxylic acid
—— {3-[2-(cyclopropylmethylamino)pyrimidin-5-yl]imidazo[1,2-b]pyridazin-6-yl}piperidin-4-ylamine 1330594-91-6 C19H24N8
{3-[2-(cyclopropylmethylamino)pyrimidin-5-yl]imidazo[1,2-b]pyridazin-6-yl}piperidin-4-ylamine
—— 5-chloro-1-methyl-N-(4-(4-(5-methyl-1H-pyrazol-3-ylamino)pyrrolo[2,1-f][1,2,4]triazin-2-ylthio)phenyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide 1315585-04-6 C22H17ClF3N9OS
5-chloro-1-methyl-N-(4-(4-(5-methyl-1H-pyrazol-3-ylamino)pyrrolo[2,1-f][1,2,4]triazin-2-ylthio)phenyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide
—— methyl 4-[[(5S,8aR)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-(naphthalen-2-ylmethyl)-3,6-dioxo-2,5,8,8a-tetrahydroimidazo[1,2-a]pyrazin-7-yl]methyl]benzoate 1319210-93-9 C36H43N5O6
methyl 4-[[(5S,8aR)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-(naphthalen-2-ylmethyl)-3,6-dioxo-2,5,8,8a-tetrahydroimidazo[1,2-a]pyrazin-7-yl]methyl]benzoate
—— (3R)-1-[(E)-4-(4-fluoro-2-methylphenyl)-4-phenylbut-3-enyl]piperidine-3-carboxylic acid 1265900-81-9 C23H26FNO2
(3R)-1-[(E)-4-(4-fluoro-2-methylphenyl)-4-phenylbut-3-enyl]piperidine-3-carboxylic acid
—— {(2R,5R,6S)-5-[bis(cyclopentylmethyl)amino]-6-[4-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-2-yl}acetic acid 1316755-86-8 C26H36F3NO3
{(2R,5R,6S)-5-[bis(cyclopentylmethyl)amino]-6-[4-(trifluoromethyl)phenyl]tetrahydro-2H-pyran-2-yl}acetic acid
—— 4-((3aS,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-(2-([furan-2-ylmethyl]amino)acetyl)-1-isopropyl-5a,5b,8,8,11a-pentamethyl-3,3a,4,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a-octadecahydro-2H-cyclopenta[a]chrysen-9-yloxy)-2,2-dimethyl-4-oxobutanoic acid 1326313-14-7 C42H63NO6
4-((3aS,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-(2-([furan-2-ylmethyl]amino)acetyl)-1-isopropyl-5a,5b,8,8,11a-pentamethyl-3,3a,4,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a-octadecahydro-2H-cyclopenta[a]chrysen-9-yloxy)-2,2-dimethyl-4-oxobutanoic acid
—— [4-[5-[2-(6-Amino-2-methylpyridin-3-yl)ethynyl]-6-ethylpyrimidin-4-yl]-2-fluorophenyl]-[4-(oxan-4-yl)piperazin-1-yl]methanone 1321606-98-7 C30H33FN6O2
[4-[5-[2-(6-Amino-2-methylpyridin-3-yl)ethynyl]-6-ethylpyrimidin-4-yl]-2-fluorophenyl]-[4-(oxan-4-yl)piperazin-1-yl]methanone
—— (3-fluoro-5-trifluoromethyl-phenyl)-(1,3,3-trimethyl-cyclohexylmethyl)-amine 1321998-60-0 C17H23F4N
(3-fluoro-5-trifluoromethyl-phenyl)-(1,3,3-trimethyl-cyclohexylmethyl)-amine
—— 5-fluoro-2-(4-morpholin-4-ylanilino)-6-[(3R)-3-(1,3-thiazol-2-ylcarbamoylamino)piperidin-1-yl]pyridine-3-carboxamide 1258320-89-6 C25H29FN8O3S
5-fluoro-2-(4-morpholin-4-ylanilino)-6-[(3R)-3-(1,3-thiazol-2-ylcarbamoylamino)piperidin-1-yl]pyridine-3-carboxamide
—— 3(R)-(Methylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one 1214165-79-3 C11H14N2O
3(R)-(Methylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one
—— 4-Amino-5-<naphthyl-(1)-sulfamoyl>-1-methyl-imidazol 106379-48-0 C14H14N4O2S
4-Amino-5-<naphthyl-(1)-sulfamoyl>-1-methyl-imidazol
—— 2-Fluoro-1-iodo-3-phenylbenzene 1214387-56-0 C12H8FI
2-Fluoro-1-iodo-3-phenylbenzene
—— cyclopentyl N-[(1S,4R,6S,14S,18R)-18-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]oxy]-4-(cyclopropylsulfonylcarbamoyl)-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-14-yl]carbamate 1275618-92-2 C44H53N7O9S2
cyclopentyl N-[(1S,4R,6S,14S,18R)-18-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]oxy]-4-(cyclopropylsulfonylcarbamoyl)-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-en-14-yl]carbamate
—— (S)-1-(2-chloro-3-fluorophenyl)ethanamine 1213215-01-0 C8H9ClFN
(S)-1-(2-chloro-3-fluorophenyl)ethanamine
—— [4-[5-[2-(6-aminopyridin-3-yl)ethynyl]-6-ethylpyrimidin-4-yl]-2-fluorophenyl]-[(2R)-2,4-dimethylpiperazin-1-yl]methanone 1321612-82-1 C26H27FN6O
[4-[5-[2-(6-aminopyridin-3-yl)ethynyl]-6-ethylpyrimidin-4-yl]-2-fluorophenyl]-[(2R)-2,4-dimethylpiperazin-1-yl]methanone
—— 5-[2-[4-Ethyl-6-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethynyl]pyridin-2-amine 1321871-40-2 C18H22N6
5-[2-[4-Ethyl-6-(4-methylpiperazin-1-yl)pyrimidin-5-yl]ethynyl]pyridin-2-amine
—— 9-methoxy-4-oxo-2-(quinolin-6-ylamino)-4H-pyrido[1,2-a]pyrimidine-3-carbonyl fluoride 1314719-20-4 C19H13FN4O3
9-methoxy-4-oxo-2-(quinolin-6-ylamino)-4H-pyrido[1,2-a]pyrimidine-3-carbonyl fluoride
—— 2-isopropyl-5-(pyrimidin-5-ylamino)-pyrimidine-4-carboxylic acid (2-methyl-5-pyridin-2-yl-2H-pyrazol-3-yl)-amide 1316121-55-7 C21H21N9O
2-isopropyl-5-(pyrimidin-5-ylamino)-pyrimidine-4-carboxylic acid (2-methyl-5-pyridin-2-yl-2H-pyrazol-3-yl)-amide
—— N-[(1-methylpiperidin-2-yl)methyl]-2-morpholin-4-yl-5-oxo-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide 1138547-78-0 C26H29N5O3S
N-[(1-methylpiperidin-2-yl)methyl]-2-morpholin-4-yl-5-oxo-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide
—— (2S)-2-[[(2S)-1-[(2S)-2-[[(3S,6S,9S,15S,21S,24S,27S,30S,33S)-33-[[(2S)-2-[(2-aminoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]-27-(4-aminobutyl)-6,21-bis[(2S)-butan-2-yl]-30-[(1R)-1-hydroxyethyl]-24-(hydroxymethyl)-5,8,14,20,23,26,29,32-octaoxo-4,7,13,19,22,25,28,31,35,36,37-undecazatetracyclo[33.2.1.09,13.015,19]octatriaconta-1(38),36-diene-3-carbonyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]butanedioic acid 1311370-90-7 C69H107N21O19
(2S)-2-[[(2S)-1-[(2S)-2-[[(3S,6S,9S,15S,21S,24S,27S,30S,33S)-33-[[(2S)-2-[(2-aminoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]-27-(4-aminobutyl)-6,21-bis[(2S)-butan-2-yl]-30-[(1R)-1-hydroxyethyl]-24-(hydroxymethyl)-5,8,14,20,23,26,29,32-octaoxo-4,7,13,19,22,25,28,31,35,36,37-undecazatetracyclo[33.2.1.09,13.015,19]octatriaconta-1(38),36-diene-3-carbonyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]butanedioic acid
—— [2-Methyl-1-(2-piperidin-1-ylethyl)indol-3-yl]-(6-propylthieno[2,3-b]pyrrol-5-yl)methanone 1328170-30-4 C26H31N3OS
[2-Methyl-1-(2-piperidin-1-ylethyl)indol-3-yl]-(6-propylthieno[2,3-b]pyrrol-5-yl)methanone
—— Pacritinib metabolite M1 1312603-77-2 C28H30N4O4
Pacritinib metabolite M1
—— [5-chloro-1'-[(E)-3-(4-chlorophenyl)prop-2-enyl]spiro[2H-indole-3,4'-piperidine]-1-yl]-(2-fluoropyridin-4-yl)methanone 1322048-52-1 C27H24Cl2FN3O
[5-chloro-1'-[(E)-3-(4-chlorophenyl)prop-2-enyl]spiro[2H-indole-3,4'-piperidine]-1-yl]-(2-fluoropyridin-4-yl)methanone
—— 4-({4-[(11β,17β)-17-hydroxy-3-oxo-17-(pentafluoroethyl)estra-4,9-dien-11-yl]benzoyl}amino)benzoic acid 1325225-94-2 C34H32F5NO5
4-({4-[(11β,17β)-17-hydroxy-3-oxo-17-(pentafluoroethyl)estra-4,9-dien-11-yl]benzoyl}amino)benzoic acid
—— (E)-3-{3-chloro-5-methyl-4-[(5-{[4-(propan-2-yl)benzyl]oxy}pyridin-2-yl)oxy]phenyl}-1-[4-(4-methylbenzyl)piperazin-1-yl]prop-2-en-1-one 1322780-98-2 C37H40ClN3O3
(E)-3-{3-chloro-5-methyl-4-[(5-{[4-(propan-2-yl)benzyl]oxy}pyridin-2-yl)oxy]phenyl}-1-[4-(4-methylbenzyl)piperazin-1-yl]prop-2-en-1-one
—— 1-methylethyl 2-(4-{[3-({[3-(trifluoromethyl)phenyl]methyl}oxy)phenyl]methyl}1-piperazinyl)-3-pyridinecarboxylate 1315555-17-9 C28H30F3N3O3
1-methylethyl 2-(4-{[3-({[3-(trifluoromethyl)phenyl]methyl}oxy)phenyl]methyl}1-piperazinyl)-3-pyridinecarboxylate
—— 3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[(1S)-1-(3,4,5-trifluorophenyl)ethyl]-5,6-dihydro-4H-[1,2]oxazolo[5,4-b]pyridine 1160359-50-1 C25H23F3N4O2
3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[(1S)-1-(3,4,5-trifluorophenyl)ethyl]-5,6-dihydro-4H-[1,2]oxazolo[5,4-b]pyridine
—— (S)-4-(1-(1-(4-fluorobenzyl)indoline-7-carboxamido)ethyl)benzoic acid 1268350-78-2 C25H23FN2O3
(S)-4-(1-(1-(4-fluorobenzyl)indoline-7-carboxamido)ethyl)benzoic acid