COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK925781
Chemical Name: (2E)-3-(6-bromo-4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-4-methylphenyl)prop-2-en-1-one
Smiles: Cc1ccc(c(c1)O)C(=O)/C=C/c1cc(Br)cc2c1OCOC2

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Molecular Weight: 375.22
Empirical Formula: C18H15BrO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.755
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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