COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK297134
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-{3-bromo-4-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1)[N+](=O)[O-])/c1nc2c([nH]1)cccc2

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Molecular Weight: 475.3
Empirical Formula: C23H15BrN4O3

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 5.922
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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