COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083800
Chemical Name: 2-amino-4-(4-chlorophenyl)-6-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)F)nc(c(c1c1ccc(cc1)Cl)C#N)N

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Saltdata: 0.12 DMF
Molecular Weight: 422.87
Empirical Formula: C21H12ClFN4OS

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 6.137
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 128
Number of rings: 3

     

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