WHO基本药物配体 - 小分子和化合物库

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(±)-沙利度胺
- ≥98%
CAS号: 50-35-1 EC号: 200-031-1 Compound CID : 5426

分子式: C₁₃H₁₀N₂O₄ 分子量: 258.23

IUPAC Name: 2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione

SMILES: C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

InChIKey: UEJJHQNACJXSKW-UHFFFAOYSA-N

InChI: 1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)
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炔雌醇
- ≥98%
CAS号: 57-63-6 EC号: 200-342-2

分子式: C₂₀H₂₄O₂ 分子量: 296.4

IUPAC Name: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol

SMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O

InChIKey: BFPYWIDHMRZLRN-SLHNCBLASA-N

InChI: 1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1
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来那度胺
- ≥99%
CAS号: 191732-72-6 EC号: 691-297-1

分子式: C₁₃H₁₃N₃O₃ 分子量: 259.27

IUPAC Name: 3-(7-amino-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione

SMILES: C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3N

InChIKey: GOTYRUGSSMKFNF-UHFFFAOYSA-N

InChI: 1S/C13H13N3O3/c14-9-3-1-2-7-8(9)6-16(13(7)19)10-4-5-11(17)15-12(10)18/h1-3,10H,4-6,14H2,(H,15,17,18)
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多巴胺
CAS号: 51-61-6

分子式: C₈H₁₁NO₂ 分子量: 153.18

IUPAC Name: 4-(2-aminoethyl)benzene-1,2-diol

SMILES: C1=CC(=C(C=C1CCN)O)O

InChIKey: VYFYYTLLBUKUHU-UHFFFAOYSA-N

InChI: 1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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环嗪
- ≥98%
CAS号: 82-92-8

分子式: C₁₈H₂₂N₂ 分子量: 266.39

IUPAC Name: 1-benzhydryl-4-methylpiperazine

SMILES: CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChIKey: UVKZSORBKUEBAZ-UHFFFAOYSA-N

InChI: 1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3
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(±)-沙利度胺
- 10mM in DMSO
CAS号: 50-35-1 EC号: 200-031-1 Compound CID : 5426

分子式: C₁₃H₁₀N₂O₄ 分子量: 258.23

IUPAC Name: 2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione

SMILES: C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

InChIKey: UEJJHQNACJXSKW-UHFFFAOYSA-N

InChI: 1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)
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