Name: Mal-Toxophore
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218929735
Cas No:2592504-91-9
常用名:Mal-Toxophore
IUPAC:N-[4-(1-{5-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetamido]pentyl}-4-methyl-6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)phenyl]-1H,2H,3H-pyrrolo[3,4-c]pyridine-2-carboxamide
IUPAC:N-[4-(1-{5-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)acetamido]pentyl}-4-methyl-6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)phenyl]-1H,2H,3H-pyrrolo[3,4-c]pyridine-2-carboxamide
InChI key:YVYJADQZQBYYED-UHFFFAOYSA-N

分子式:C30H33N7O5
分子量:571.638
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC1CC(=O)N(CCCCCNC(=O)CN2C(=O)C=CC2=O)N=C1c1ccc(NC(=O)N2Cc3ccncc3C2)cc1
SMILES:CC1CC(=O)N(CCCCCNC(=O)CN2C(=O)C=CC2=O)N=C1c1ccc(NC(=O)N2Cc3ccncc3C2)cc1

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