COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK846666
Chemical Name: methyl6-({2-[(3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-hydroxy-4-[4-(propan-2-yl)phenyl]-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)C(C)C)C#N)SCC(=O)Nc1cccc(c1)Cl)O

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Molecular Weight: 498
Empirical Formula: C25H24ClN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.302
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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