COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322768
Chemical Name: (2E)-1-[2-(benzyloxy)-5-chlorophenyl]-3-(6-bromo-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Smiles: Clc1ccc(c(c1)C(=O)/C=C/c1cc(Br)cc2c1OCOC2)OCc1ccccc1

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Molecular Weight: 485.76
Empirical Formula: C24H18BrClO4

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 6.582
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 4

     

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