COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538595
Chemical Name: butyl{[3-cyano-4-(2,3-dichlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSC1=C(C(CC(=O)N1)c1cccc(c1Cl)Cl)C#N

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Molecular Weight: 413.32
Empirical Formula: C18H18Cl2N2O3S

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 5.691
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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