COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564663
Chemical Name: ethyl5-cyano-4-(2-ethoxyphenyl)-2-hydroxy-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-3,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1C(=NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1c(C)cc(cc1C)C)O

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Molecular Weight: 521.64
Empirical Formula: C28H31N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.599
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 146
Number of rings: 3

     

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