COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521750
Chemical Name: 2-{(E)-2-[2-(acetyloxy)-3-bromo-5-chlorophenyl]ethenyl}quinolin-8-ylacetate
Smiles: CC(=O)Oc1c(/C=C/c2ccc3c(n2)c(ccc3)OC(=O)C)cc(cc1Br)Cl

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Molecular Weight: 460.71
Empirical Formula: C21H15BrClNO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.102
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 65
Number of rings: 3

     

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