COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047207
Chemical Name: 2-bromo-4-[1-(3-bromo-4-hydroxy-5-methoxybenzyl)-1H-3,1-benzimidazol-3-ium-2-yl]-6-methoxyphenolate
Smiles: COc1cc(cc(c1[O-])Br)c1[nH+]c2c(n1Cc1cc(Br)c(c(c1)OC)O)cccc2

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Molecular Weight: 534.2
Empirical Formula: C22H18Br2N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.637
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 80
Number of rings: 4

     

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