COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381201
Chemical Name: (2E)-3-(4-bromophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Smiles: Brc1ccc(cc1)/C=C/C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 345.19
Empirical Formula: C17H13BrO3

Physical State: Dry powder
Available Amount: 504 mg

Lipinsky:
logP: 5.071
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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