COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK076034
Chemical Name: cyclopentyl7-(3,4-dimethoxyphenyl)-2-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CSc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(c(c2)OC)OC)NC(=C1C(=O)OC1CCCC1)C

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Molecular Weight: 533.69
Empirical Formula: C31H35NO5S

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 5.027
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 99
Number of rings: 5

     

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