COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826546
Chemical Name: 2-{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(4-fluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2cccc(c2)Cl)NC2=C(C1c1ccc(cc1)F)C(=O)CCC2

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Molecular Weight: 452.94
Empirical Formula: C24H18ClFN2O2S

Available Amount: 0 mg

Lipinsky:
logP: 4.701
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 4

     

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