COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886412
Chemical Name: ethyl2-{[4-(2-chlorophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(SC1=C(C#N)C(CC(=O)N1)c1ccccc1Cl)C

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Molecular Weight: 364.85
Empirical Formula: C17H17ClN2O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.506
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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