COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443468
Chemical Name: (4E)-4-(2-hydroxy-5-nitrobenzylidene)-1-(4-methylphenyl)pyrazolidine-3,5-dione
Smiles: Cc1ccc(cc1)N1NC(=O)/C(=C\c2cc(ccc2O)[N+](=O)[O-])/C1=O

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Molecular Weight: 339.31
Empirical Formula: C17H13N3O5

Physical State: Dry powder
Available Amount: 73 mg

Lipinsky:
logP: 3.91
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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