COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322848
Chemical Name: (2E)-3-(6-chloro-4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-3-methylphenyl)prop-2-en-1-one
Smiles: Clc1cc(/C=C/C(=O)c2cccc(c2O)C)c2c(c1)COCO2

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Molecular Weight: 330.77
Empirical Formula: C18H15ClO4

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 4.358
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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