COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037631
Chemical Name: methyl4-(4-chlorophenyl)-5-cyano-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1ccc(cc1)F)O

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Molecular Weight: 473.91
Empirical Formula: C22H17ClFN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.223
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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