COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521692
Chemical Name: 2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]quinolin-8-ylpropanoate
Smiles: CCC(=O)Oc1cccc2c1nc(/C=C/c1cc3OCOc3cc1Br)cc2

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Molecular Weight: 426.27
Empirical Formula: C21H16BrNO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.202
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 57
Number of rings: 4

     

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