Name: Velusetrag hydrochloride
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT214320369
Cas No:866933-51-9
常用名:Velusetrag hydrochloride
别名:TD-5108, TD5108, TD 5108
IUPAC:N-[(1R,3R,5S)-8-[(2R)-2-hydroxy-3-(N-methylmethanesulfonamido)propyl]-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-(propan-2-yl)-1,2-dihydroquinoline-3-carboxamide hydrochloride
IUPAC:N-[(1R,3R,5S)-8-[(2R)-2-hydroxy-3-(N-methylmethanesulfonamido)propyl]-8-azabicyclo[3.2.1]octan-3-yl]-2-oxo-1-(propan-2-yl)-1,2-dihydroquinoline-3-carboxamide hydrochloride
InChI key:BLIKSWRONBYRDD-ULYYJTHRSA-N

分子式:C25H37ClN4O5S
分子量:541.1
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cl.[H][C@]12CC[C@]([H])(C[C@@H](C1)NC(=O)c1cc3ccccc3n(C(C)C)c1=O)N2C[C@@H](O)CN(C)S(C)(=O)=O |TLB:10:8:27:3.4|
SMILES:Cl.[H][C@]12CC[C@]([H])(C[C@@H](C1)NC(=O)c1cc3ccccc3n(C(C)C)c1=O)N2C[C@@H](O)CN(C)S(C)(=O)=O |TLB:10:8:27:3.4|

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