PF-05221304
HIT213840303
sdf文件结构编辑类似物检索
HIT ID: HIT213840303
Cas No: 1370448-25-1
分子式: C28H30N4O5
分子量: 502.571
常用名: PF-05221304
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-(6-methoxy-4-{[7-oxo-1-(propan-2-yl)-1,4,6,7-tetrahydrospiro[indazole-5,4'-piperidin]-1'-yl]carbonyl}pyridin-2-yl)benzoic acid
IUPAC: 4-(6-methoxy-4-{[7-oxo-1-(propan-2-yl)-1,4,6,7-tetrahydrospiro[indazole-5,4'-piperidin]-1'-yl]carbonyl}pyridin-2-yl)benzoic acid
SMILES: COc1cc(cc(n1)-c1ccc(cc1)C(O)=O)C(=O)N1CCC2(CC1)Cc1cnn(C(C)C)c1C(=O)C2
SMILES: COc1cc(cc(n1)-c1ccc(cc1)C(O)=O)C(=O)N1CCC2(CC1)Cc1cnn(C(C)C)c1C(=O)C2
InChI key: LXZMHBHEXAELHH-UHFFFAOYSA-N
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