COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040011
Chemical Name: 2-{3-bromo-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-1H-indene-1,3(2H)-dione
Smiles: CCOc1cc(cc(c1OCc1ccc(cc1)F)Br)/C=C/1\C(=O)c2c(C1=O)cccc2

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Molecular Weight: 481.32
Empirical Formula: C25H18BrFO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.761
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 4

     

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