COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401541
Chemical Name: (2E)-3-{5-[(4-bromo-2-chlorophenoxy)methyl]furan-2-yl}-1-(1-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: Brc1ccc(c(c1)Cl)OCc1ccc(o1)/C=C/C(=O)c1cnn(c1)C

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Molecular Weight: 421.68
Empirical Formula: C18H14BrClN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.101
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 3

     

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