COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044621
Chemical Name: methyl6-{[2-(benzylamino)-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)NCc1ccccc1)O

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Molecular Weight: 469.95
Empirical Formula: C23H20ClN3O4S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.591
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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