COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045367
Chemical Name: (4E)-4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=N/Nc1ccc(cc1Br)[N+](=O)[O-])c1scc(n1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 530.32
Empirical Formula: C19H12BrN7O5S

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 3.232
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 189
Number of rings: 4

     

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