Ras inhibitor 134
HIT217583300
sdf文件结构编辑类似物检索
HIT ID: HIT217583300
Cas No: 2648552-54-7
分子式: C23H21ClFN5O3
分子量: 469.9
常用名: Ras inhibitor 134
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-[(7R)-5-[(2S)-aziridine-2-carbonyl]-12-chloro-10-oxa-2,5,16,18-tetraazatetracyclo[9.7.1.0^{2,7}.0^{15,19}]nonadeca-1(19),11,13,15,17-pentaen-13-yl]-3-fluorophenol
IUPAC: 2-[(7R)-5-[(2S)-aziridine-2-carbonyl]-12-chloro-10-oxa-2,5,16,18-tetraazatetracyclo[9.7.1.0^{2,7}.0^{15,19}]nonadeca-1(19),11,13,15,17-pentaen-13-yl]-3-fluorophenol
SMILES: [H][C@@]12CN(CCN1c1ncnc3cc(c(Cl)c(OCC2)c13)-c1c(O)cccc1F)C(=O)[C@@H]1CN1
SMILES: [H][C@@]12CN(CCN1c1ncnc3cc(c(Cl)c(OCC2)c13)-c1c(O)cccc1F)C(=O)[C@@H]1CN1
InChI key: PIPHVUBZMLKXGQ-WBMJQRKESA-N
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