COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK058952
Chemical Name: (4Z)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-4-[2-(2-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccccc2[N+](=O)[O-])/C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 543.52
Empirical Formula: C25H17N7O6S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.304
Rotatable bonds: 0
H-donors: 1
H-acceptors: 6
PSA: 199
Number of rings: 5

     

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