COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541875
Chemical Name: methyl6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SCC(=O)NCc1ccccc1

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Molecular Weight: 453.49
Empirical Formula: C23H20FN3O4S

Physical State: Dry powder
Available Amount: 336 mg

Lipinsky:
logP: 4.338
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 3

     

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