COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553057
Chemical Name: 2-methoxyethyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1c(C)cc(cc1C)C

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Molecular Weight: 540.08
Empirical Formula: C28H30ClN3O4S

Physical State: Dry powder
Available Amount: 359 mg

Lipinsky:
logP: 5.257
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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