COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507297
Chemical Name: (4Z)-5-hydroxy-4-[(2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OC1=NN(C(=O)/C/1=C\C=C\c1cccc(c1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 335.32
Empirical Formula: C18H13N3O4

Physical State: Dry powder
Available Amount: 211 mg

Lipinsky:
logP: 2.879
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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