COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432758
Chemical Name: (4E)-1-(4-chlorophenyl)-4-(2,3-dibromo-5-ethoxy-4-hydroxybenzylidene)pyrazolidine-3,5-dione
Smiles: CCOc1cc(/C=C/2\C(=O)NN(C2=O)c2ccc(cc2)Cl)c(c(c1O)Br)Br

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Molecular Weight: 516.57
Empirical Formula: C18H13Br2ClN2O4

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 5.972
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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