COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550747
Chemical Name: 5-cyano-6-({2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: CCOc1ccc(cc1)C1C(=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C1C(=O)Nc1ccccc1)C)C#N

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Molecular Weight: 552.7
Empirical Formula: C32H32N4O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.508
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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