COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK011387
Chemical Name: (4E)-4-[2-(2,4-dimethylphenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: Cc1ccc(c(c1)C)N/N=C/1\C(=NN(C1=O)C(=S)N)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 396.43
Empirical Formula: C18H16N6O3S

Available Amount: 0 mg

Lipinsky:
logP: 2.184
Rotatable bonds: 0
H-donors: 3
H-acceptors: 3
PSA: 160
Number of rings: 3

     

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