COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091637
Chemical Name: 5-acetyl-6-methyl-4-(2-methylpropyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=C(C1CC(C)C)C(=O)C)C

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Molecular Weight: 368.5
Empirical Formula: C21H24N2O2S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.858
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 2

     

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