COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287703
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-(2,3-dibromo-5-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
Smiles: CCOc1cc(/C=C(/c2nc3c([nH]2)cccc3)\C#N)c(c(c1O)Br)Br

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Molecular Weight: 463.13
Empirical Formula: C18H13Br2N3O2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 6.162
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 81
Number of rings: 3

     

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