Name: C5aR-IN-1
Rating: 5 (10 reviews)

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类似物检索

HIT ID:HIT220912809
Cas No:2761048-02-4
常用名:C5aR-IN-1
IUPAC:(2R,3S,4aR,7aR)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]-octahydro-1H-cyclopenta[b]pyridine-3-carboxamide
IUPAC:(2R,3S,4aR,7aR)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]-octahydro-1H-cyclopenta[b]pyridine-3-carboxamide
InChI key:InChIKey=GFPFPJUWYULVHK-YUQOACCUSA-N

分子式:C36H39F4N3O2
分子量:621.721
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12CCC[C@@]1([H])N([C@H]([C@H](C2)C(=O)Nc1ccc(C)c(c1)C(F)(F)F)c1ccc(NC2CCCC2)cc1)C(=O)c1c(C)cccc1F
SMILES:[H][C@]12CCC[C@@]1([H])N([C@H]([C@H](C2)C(=O)Nc1ccc(C)c(c1)C(F)(F)F)c1ccc(NC2CCCC2)cc1)C(=O)c1c(C)cccc1F

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