COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538185
Chemical Name: benzyl5-cyano-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-4-[4-(propan-2-yl)phenyl]-1,4-dihydropyridine-3-carboxylate
Smiles: CCc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)OCc1ccccc1)c1ccc(cc1)C(C)C

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Molecular Weight: 565.74
Empirical Formula: C34H35N3O3S

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 7.391
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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