COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079008
Chemical Name: (4Z)-2-(4-tert-butyl-1,3-thiazol-2-yl)-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1/C(=N\Nc2c(C)cccc2[N+](=O)[O-])/C(=NN1c1scc(n1)C(C)(C)C)c1ccccc1

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Molecular Weight: 462.53
Empirical Formula: C23H22N6O3S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 5.15
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 4

     

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