COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378548
Chemical Name: methyl4-[(4E)-4-(3-ethoxy-4-hydroxybenzylidene)-3,5-dioxopyrazolidin-1-yl]benzoate
Smiles: CCOc1cc(ccc1O)/C=C/1\C(=O)NN(C1=O)c1ccc(cc1)C(=O)OC

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Molecular Weight: 382.37
Empirical Formula: C20H18N2O6

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 2.911
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 105
Number of rings: 3

     

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