COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL233330
Chemical Name: 1,4-dimethyl-5-{(Z)-[3-(3-methylbutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-6-(piperidin-1-yl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCC(C)C)c(n(c1=O)C)N1CCCCC1

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Molecular Weight: 444.62
Empirical Formula: C22H28N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.279
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 125
Number of rings: 3

     

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