COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK826789
Chemical Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc(c2)C(F)(F)F)NC(=C(C1c1ccccc1Cl)C(=O)Nc1ccccc1)C

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Molecular Weight: 583.03
Empirical Formula: C29H22ClF3N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.854
Rotatable bonds: 5
H-donors: 3
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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