COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701386
Chemical Name: 4-{(Z)-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl3-nitrobenzoate
Smiles: S=C1S/C(=C\c2ccc(cc2)OC(=O)c2cccc(c2)[N+](=O)[O-])/C(=O)N1c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 572.62
Empirical Formula: C28H20N4O6S2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 4.355
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 173
Number of rings: 5

     

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