COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507609
Chemical Name: (4Z)-4-[3,5-dibromo-2-(prop-2-en-1-yloxy)benzylidene]-2-(3,4-dimethylphenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Smiles: C=CCOc1c(cc(cc1Br)Br)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C)C)O

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Molecular Weight: 506.19
Empirical Formula: C21H18Br2N2O3

Physical State: Dry powder
Available Amount: 282 mg

Lipinsky:
logP: 6.594
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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