COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK389051
Chemical Name: 3-[(4Z)-4-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: COc1cc(/C=C\2/C(=NN(C2=O)c2cccc(c2)C(=O)O)C)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 397.34
Empirical Formula: C19H15N3O7

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 2.919
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 145
Number of rings: 3

     

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