生物活性小分子, Small Molecules

别名：(E)-1- [4-(2-氧代-2-吡咯烷-1-基乙基)哌嗪-1-基] -3-(3,4,5-三甲氧基苯基)丙-2-烯-1-马来酸酯；1-(吡咯烷基-1-羰基)-甲基-4-(3,4,5-三甲氧基肉桂酰基)-哌嗪-马来酸酯；(E)-1-[4-(2-Oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one maleate, 1-(Pyrrolidinyl-1-carbonyl)-methyl-4-(3,4,5-trimethoxycinnamoyl)-piperazine-maleate

Empirical Formula (Hill Notation): C22H31N3O5 · C4H4O4 CAS号: 26328-04-1 分子量: 533.57 MDL编号: MFCD01320526 PubChem化学物质编号: 329825922

别名：4-(4-苯并呋喃zanyl)-1,-4-二氢-2,6-二甲基-3,5-吡啶二羧酸甲基1-甲基乙基酯；4-(4-Benzofurazanyl)-1,-4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic acid methyl 1-methylethyl ester

Empirical Formula (Hill Notation): C19H21N3O5 CAS号: 75695-93-1 分子量: 371.39 MDL编号: MFCD00153820 PubChem化学物质编号: 24724517 NACRES: NA.77

别名：1-[(4R,5R)-4,5-二羟基-N2-[[4′′-戊氧基)[1,1′:4′,1′′-三联苯]-4-基]羰基]-L-鸟氨酸]棘白菌素B；1-[(4R,5R)-4,5-Dihydroxy-N2-[[4′′-(pentyloxy)[1,1′:4′,1′′-terphenyl]-4-yl]carbonyl]-L-ornithine]echinocandin B；LY 303366

Empirical Formula (Hill Notation): C58H73N7O17 CAS号: 166663-25-8 分子量: 1140.24 MDL编号: MFCD00917070 NACRES: NA.77

CAS：1001600-56-1；分子式：C70H96N10O8；分子量：1205.67

别名：(2S)-1-[(2S)-2-Cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]-N-[(2S)-1-[6-[[(2S)-2-[[(2S)-1-[(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)propanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]-3,3-diphenylpropanoyl]amino]hexylamino]-1-oxo-3,3-diphenylpropan-2-yl]pyrrolidine-2-carboxamide

别名：N-(苄基脒)-3,5-二氨基-6-氯吡嗪甲酰胺；N-(N-Benzylamidino)-3,5-diamino-6-chloropyrazine carboxamide

CAS：2898-76-2；分子式：C13H14ClN7O；分子量：319.75

别名：N-(苄基脒)-3,5-二氨基-6-氯吡嗪甲酰胺盐酸盐水合物；N-(Benzylamidino)-3,5-diamino-6-chloropyrazinecarboxamide hydrochloride hydrate

Empirical Formula (Hill Notation): C13H14ClN7O · HCl · xH2O CAS号: 161804-20-2 分子量: 356.21 (anhydrous basis) PubChem化学物质编号: 24278262 NACRES: NA.77

别名：(R)-4-(4-((4'-氯-4,4-二甲基-3,4,5,6-四氢-[1,1'-联苯]-2-基)甲基)哌嗪-1-基)-N-((4-((4-吗啉-1-(苯硫基)丁烷-2-基)氨基)-3-((三氟甲基)磺酰)苯基)磺酰)苯甲酰胺；(R)-4-(4-((4'-Chloro-4,4-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazin-1-yl)-N-((4-((4-morpholino-1-(phenylthio)butan-2-yl)amino)-3-((trifluoromethyl)sulfonyl)phenyl)sulfonyl)benzamide

MDL number MFCD12756219；Cas Number : 923564-51-6；分子式：C47H55ClF3N5O6S3；Molecular Weight : 974.63

别名：N1,N2-bis((3-imino-6-methyl-3H-indol-2-yl)methyl)-N1,N2-bis((6-methyl-1H-benzo[d]imidazol-2-yl)methyl)ethane-1,2-diamine hydrate；N1,N1,N2,N2-四[(6-甲基-1H-苯并咪唑-2-基)甲基]-1,2-乙二胺

Empirical Formula (Hill Notation): C38H40N10 · xH2O 分子量: 636.79 (anhydrous basis) PubChem化学物质编号: 329818608

别名：甲磺酸奥巴克拉；(Z)-2-(2-(((3,5-二甲基-1H-吡咯-2-基)亚甲基)-3-甲氧基-2H-吡咯-5-基)-1H-吲哚甲磺酸盐；(Z)-2-(2-((3,5-dimethyl-1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-1H-indole methanesulfonate

Empirical Formula (Hill Notation): C20H19N3O · CH4O3S CAS号: 803712-79-0 分子量: 413.49 MDL编号: MFCD18074508

别名：2,7-双(哌啶-1-基磺酰基)-9H-芴-9-酮肟；1,1'-[[9-(羟基亚氨基)-9H-芴-2,7-二基]双(磺酰基)]双哌啶；2,7-双(1-哌啶基磺酰基)-9H-芴-9-一 肟；1,1′-[[9-(Hydroxyimino)-9H-fluorene-2,7-diyl]bis(sulfonyl)]bis-piperidine；2,7-bis(1-Piperidinylsulfonyl)-9H-fluoren-9-one oxime；CIL56

Empirical Formula (Hill Notation): C23H27N3O5S2 CAS号: 300802-28-2 分子量: 489.61 MDL编号: MFCD00323348

别名：3-氨基-4-环己基氨基苯甲酸乙酯；铁抑制剂1；3-Amino-4-cyclohexylaminobenzoic acid ethyl ester

Empirical Formula (Hill Notation): C15H22N2O2 CAS号: 347174-05-4 分子量: 262.35 NACRES: NA.77

别名：N-[(3-氯苯基)甲基] 螺-[4H-喹喔啉-3,4′-哌啶 ]-2-胺；N-[(3-氯苯基)甲基]-螺 [哌啶-4,2′ (1′H)-喹喔啉]-3′-胺；利普司他丁1；N-[(3-Chlorophenyl)methyl]-spiro[piperidine-4,2′(1′H)-quinoxalin]-3′-amine；N-[(3-chlorophenyl)methyl]spiro[4H-quinoxaline-3,4′-piperidine]-2-amine

Empirical Formula (Hill Notation): C19H21ClN4 CAS号: 950455-15-9 分子量: 340.85 MDL编号: MFCD14948691 PubChem化学物质编号: 329825860