Name: U 80215
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT220912253
Cas No:123300-09-4
常用名:U 80215
IUPAC:5-{2-[5-(dimethylamino)naphthalene-1-sulfonamido]-3-(1H-imidazol-5-yl)propanamido}-4-hydroxy-7-methyl-N-(2-methyl-1-{[(pyridin-2-yl)methyl]carbamoyl}butyl)-2-(propan-2-yl)octanamide
IUPAC:5-{2-[5-(dimethylamino)naphthalene-1-sulfonamido]-3-(1H-imidazol-5-yl)propanamido}-4-hydroxy-7-methyl-N-(2-methyl-1-{[(pyridin-2-yl)methyl]carbamoyl}butyl)-2-(propan-2-yl)octanamide
InChI key:InChIKey=TZVFBLXCGCHIFW-UHFFFAOYSA-N

分子式:C42H60N8O6S
分子量:805.05
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCC(C)C(NC(=O)C(CC(O)C(CC(C)C)NC(=O)C(Cc1cnc[nH]1)NS(=O)(=O)c1cccc2c(cccc12)N(C)C)C(C)C)C(=O)NCc1ccccn1
SMILES:CCC(C)C(NC(=O)C(CC(O)C(CC(C)C)NC(=O)C(Cc1cnc[nH]1)NS(=O)(=O)c1cccc2c(cccc12)N(C)C)C(C)C)C(=O)NCc1ccccn1

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