COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL112895
Chemical Name: ethyl6'-[(2-butoxy-2-oxoethyl)sulfanyl]-5'-cyano-2'-phenyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxylate
Smiles: CCCCOC(=O)CSC1=C(C#N)C(C(=C(N1)c1ccccc1)C(=O)OCC)c1cccnc1

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Molecular Weight: 477.58
Empirical Formula: C26H27N3O4S

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 4.86
Rotatable bonds: 11
H-donors: 1
H-acceptors: 4
PSA: 126
Number of rings: 3

     

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