COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK885682
Chemical Name: ethyl4-{[(5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridin-3-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)c1ccc(cc1)C

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Molecular Weight: 551.67
Empirical Formula: C32H29N3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.973
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 4

     

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