COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810222
Chemical Name: (5Z)-5-{[3-(4-butoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCOc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC)c1ccccc1

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Molecular Weight: 477.65
Empirical Formula: C26H27N3O2S2

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 6.324
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 104
Number of rings: 4

     

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