COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040187
Chemical Name: methyl6-({2-[(3-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-hydroxy-4-(2-methoxyphenyl)-3,4-dihydropyridine-3-carboxylate
Smiles: COC(=O)C1C(=NC(=C(C1c1ccccc1OC)C#N)SCC(=O)Nc1cccc(c1)C(=O)C)O

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Molecular Weight: 493.54
Empirical Formula: C25H23N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.172
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 163
Number of rings: 3

     

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