COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699412
Chemical Name: methyl4-(4-chlorophenyl)-5-cyano-2-oxo-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1c(C)cc(cc1C)C

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Molecular Weight: 498
Empirical Formula: C25H24ClN3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.506
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 3

     

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