COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809029
Chemical Name: (5Z)-5-(4-bromobenzylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Brc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 486.41
Empirical Formula: C21H16BrN3O2S2

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 3.963
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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