COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK752854
Chemical Name: (4E)-1-(3,4-dimethylphenyl)-4-(3-nitrobenzylidene)pyrazolidine-3,5-dione
Smiles: O=C1NN(C(=O)/C/1=C/c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)C)C

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Molecular Weight: 337.33
Empirical Formula: C18H15N3O4

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 3.994
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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