COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860684
Chemical Name: methyl4-(4-chlorophenyl)-5-cyano-6-(ethylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccc(cc1)Cl

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Molecular Weight: 350.83
Empirical Formula: C16H15ClN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.184
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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