Ceratamine B
HIT218929733
sdf文件结构编辑类似物检索
HIT ID: HIT218929733
Cas No: 634151-16-9
分子式: C16H14Br2N4O2
分子量: 454.122
常用名: Ceratamine B
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-[(3,5-dibromo-4-methoxyphenyl)methyl]-2-(methylamino)-5H,6H-imidazo[4,5-d]azepin-5-one
IUPAC: 4-[(3,5-dibromo-4-methoxyphenyl)methyl]-2-(methylamino)-5H,6H-imidazo[4,5-d]azepin-5-one
SMILES: CNc1nc2cc[nH]c(=O)c(Cc3cc(Br)c(OC)c(Br)c3)c2n1
SMILES: CNc1nc2cc[nH]c(=O)c(Cc3cc(Br)c(OC)c(Br)c3)c2n1
InChI key: UCJCVNFPNDGXHS-UHFFFAOYSA-N
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