BChE-IN-38
HIT219250925
sdf文件结构编辑类似物检索
HIT ID: HIT219250925
Cas No: 3054159-55-3
分子式: C27H20N4
分子量: 400.485
常用名: BChE-IN-38
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-{[1-(naphthalen-1-yl)-1H-1,2,3-triazol-4-yl]methyl}-2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,9,11,13-heptaene
IUPAC: 2-{[1-(naphthalen-1-yl)-1H-1,2,3-triazol-4-yl]methyl}-2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,9,11,13-heptaene
SMILES: C(N1c2ccccc2C=Cc2ccccc12)c1cn(nn1)-c1cccc2ccccc12
SMILES: C(N1c2ccccc2C=Cc2ccccc12)c1cn(nn1)-c1cccc2ccccc12
InChI key: HQJFCMDFLBHTLU-UHFFFAOYSA-N
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