COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK607597
Chemical Name: (5Z)-5-(3,5-di-tert-butyl-4-hydroxybenzylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C\c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)/C(=O)N1c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 535.73
Empirical Formula: C29H33N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.913
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 121
Number of rings: 4

     

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