COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980408
Chemical Name: 2-{(E)-2-[2-(acetyloxy)-3-bromo-5-methoxyphenyl]ethenyl}quinolin-8-ylacetate
Smiles: COc1cc(/C=C/c2ccc3c(n2)c(ccc3)OC(=O)C)c(c(c1)Br)OC(=O)C

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Molecular Weight: 456.29
Empirical Formula: C22H18BrNO5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.791
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 74
Number of rings: 3

     

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