COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401542
Chemical Name: (2E)-1-(1-methyl-1H-pyrazol-4-yl)-3-{5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl}prop-2-en-1-one
Smiles: Clc1cc(Cl)c(c(c1)Cl)OCc1ccc(o1)/C=C/C(=O)c1cnn(c1)C

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Molecular Weight: 411.67
Empirical Formula: C18H13Cl3N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.388
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 3

     

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