COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007334
Chemical Name: 4-chlorophenyl{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetate
Smiles: COc1cc(cc(c1OC)OC)C1C(=C(SCC(=O)Oc2ccc(cc2)Cl)NC2=C1C(=O)CCC2)C#N

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Molecular Weight: 541.02
Empirical Formula: C27H25ClN2O6S

Available Amount: 0 mg

Lipinsky:
logP: 3.741
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 132
Number of rings: 4

     

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