COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416517
Chemical Name: methyl4-(4-chlorophenyl)-5-cyano-2-oxo-6-[(2-phenylethyl)sulfanyl]-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCCc1ccccc1

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Molecular Weight: 426.92
Empirical Formula: C22H19ClN2O3S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 5.899
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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