COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017443
Chemical Name: 5-acetyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-methyl-4-(2-methylpropyl)-1,4-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Cl)NC(=C(C1CC(C)C)C(=O)C)C

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Molecular Weight: 402.94
Empirical Formula: C21H23ClN2O2S

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 4.543
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 2

     

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