COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052047
Chemical Name: 6-(4-benzylpiperazin-1-yl)-1,4-dimethyl-5-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)C)c(n(c1=O)C)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 569.75
Empirical Formula: C31H31N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.393
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 128
Number of rings: 5

     

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