COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611363
Chemical Name: prop-2-en-1-yl6-(butylsulfanyl)-4-(2-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: CCCCSC1=C(C#N)C(C(=C(N1)C)C(=O)OCC=C)c1ccccc1Cl

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Molecular Weight: 402.94
Empirical Formula: C21H23ClN2O2S

Physical State: Dry powder
Available Amount: 342 mg

Lipinsky:
logP: 5.053
Rotatable bonds: 9
H-donors: 1
H-acceptors: 2
PSA: 87
Number of rings: 2

     

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