COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK746995
Chemical Name: ethyl4-{[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1nc(cc(c1C#N)c1ccc(cc1)Cl)c1cccs1

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Molecular Weight: 456.97
Empirical Formula: C22H17ClN2O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.358
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 133
Number of rings: 3

     

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