COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372323
Chemical Name: (2E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)prop-2-en-1-one
Smiles: Clc1ccc(cc1)C(=O)/C=C/c1cc2OCOc2cc1Br

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Molecular Weight: 365.61
Empirical Formula: C16H10BrClO3

Physical State: Dry powder
Available Amount: 279 mg

Lipinsky:
logP: 5.803
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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