COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886202
Chemical Name: 2-{[3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C(F)(F)F)NC2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2

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Molecular Weight: 573.59
Empirical Formula: C28H26F3N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.695
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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