COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL298231
Chemical Name: (2E)-1-(3-bromo-2-hydroxyphenyl)-3-(6-chloro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Smiles: Clc1cc(/C=C/C(=O)c2cccc(c2O)Br)c2c(c1)COCO2

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Molecular Weight: 395.64
Empirical Formula: C17H12BrClO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.088
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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