COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416142
Chemical Name: methyl6-[(2-{[4-chloro-3-(trifluoromethyl)phenyl]amino}-2-oxoethyl)sulfanyl]-5-cyano-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

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Molecular Weight: 537.95
Empirical Formula: C24H19ClF3N3O4S

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 7.216
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 3

     

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