COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561770
Chemical Name: methyl6-({2-[(3-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-chlorophenyl)-5-cyano-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1cccc(c1)C(=O)C)O

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Molecular Weight: 497.96
Empirical Formula: C24H20ClN3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.852
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 154
Number of rings: 3

     

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