COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827312
Chemical Name: ethyl5-cyano-4-(3-methylthiophen-2-yl)-2-phenyl-6-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCSC1=C(C#N)C(C(=C(N1)c1ccccc1)C(=O)OCC)c1sccc1C

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Molecular Weight: 422.57
Empirical Formula: C23H22N2O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.262
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 115
Number of rings: 3

     

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