COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432724
Chemical Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione
Smiles: O=C1NN(C(=O)/C/1=C/c1ccc2c(c1)OCO2)c1ccc(c(c1)C)C

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Molecular Weight: 336.35
Empirical Formula: C19H16N2O4

Physical State: Dry powder
Available Amount: 193 mg

Lipinsky:
logP: 4.215
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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