COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886206
Chemical Name: methyl5-cyano-4-(4-ethoxyphenyl)-6-[(2-{[2-(methoxycarbonyl)phenyl]amino}-2-oxoethyl)sulfanyl]-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SCC(=O)Nc1ccccc1C(=O)OC

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Molecular Weight: 523.57
Empirical Formula: C26H25N3O7S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 169
Number of rings: 3

     

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