COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK885814
Chemical Name: methyl2-({[(3-cyano-5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)Nc1ccccc1C(=O)OC

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Molecular Weight: 610.69
Empirical Formula: C33H30N4O6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.651
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 171
Number of rings: 4

     

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