COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287685
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-{2-bromo-5-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: COc1cc(/C=C(/c2nc3c([nH]2)cccc3)\C#N)c(cc1OCc1ccc(cc1)[N+](=O)[O-])Br

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Molecular Weight: 505.33
Empirical Formula: C24H17BrN4O4

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 6.323
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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