COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025100
Chemical Name: (4Z)-4-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-5-(4-nitrophenyl)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=N/Nc1nc2c(s1)cccc2)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 442.46
Empirical Formula: C22H14N6O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.132
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 5

     

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