Name: Maraviroc
Rating: 5 (10 reviews)

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HIT ID:HIT212651195
Cas No:376348-65-1
常用名:Maraviroc
别名:马拉维若, UK-427857, Selzentry, Celsentri
IUPAC:4,4-difluoro-N-[(1S)-3-[(1R,3R,5S)-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]cyclohexane-1-carboxamide
IUPAC:4,4-difluoro-N-[(1S)-3-[(1R,3R,5S)-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]cyclohexane-1-carboxamide
InChI key:GSNHKUDZZFZSJB-QYOOZWMWSA-N

分子式:C29H41F2N5O
分子量:513.678
氢键供体数 (HBD):1
氢键受体数 (HBA):4
LogP:3.6262107
SMILES:CC(C)c1nnc(C)n1[C@H]1C[C@@H]2CC[C@H](C1)N2CC[C@H](NC(=O)C1CCC(F)(F)CC1)c1ccccc1 |TLB:17:16:12.13:9.10.15|
SMILES:CC(C)c1nnc(C)n1[C@H]1C[C@@H]2CC[C@H](C1)N2CC[C@H](NC(=O)C1CCC(F)(F)CC1)c1ccccc1 |TLB:17:16:12.13:9.10.15|

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