COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815637
Chemical Name: (5Z)-5-(4-butoxy-3-ethoxybenzylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCOc1ccc(cc1OCC)/C=C/1\SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 523.68
Empirical Formula: C27H29N3O4S2

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.025
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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