COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431812
Chemical Name: (4Z)-4-(3-bromo-4-hydroxy-5-methoxybenzylidene)-1-(3-chlorophenyl)pyrazolidine-3,5-dione
Smiles: COc1cc(/C=C\2/C(=O)NN(C2=O)c2cccc(c2)Cl)cc(c1O)Br

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Molecular Weight: 423.65
Empirical Formula: C17H12BrClN2O4

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 4.166
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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