COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886031
Chemical Name: benzyl4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OCc1ccccc1)c1ccccc1Cl

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Molecular Weight: 482.99
Empirical Formula: C25H23ClN2O4S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 5.282
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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