COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK049926
Chemical Name: (4Z)-4-[2-(1,3-benzothiazol-2-yl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: NC(=S)N1N=C(/C(=N/Nc2nc3c(s2)cccc3)/C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 425.45
Empirical Formula: C17H11N7O3S2

Available Amount: 0 mg

Lipinsky:
logP: 2.084
Rotatable bonds: 0
H-donors: 3
H-acceptors: 3
PSA: 202
Number of rings: 4

     

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