COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324175
Chemical Name: [(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinolin-2-yl)sulfanyl]aceticacid
Smiles: N#CC1=C(SCC(=O)O)NC2=C(C1c1ccccc1)C(=O)CC(C2)(C)C

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Molecular Weight: 368.46
Empirical Formula: C20H20N2O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.04
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 3

     

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