COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113942
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1Cl)Cl)/c1nc2c([nH]1)cccc2

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Molecular Weight: 499.19
Empirical Formula: C23H14BrCl2N3O

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 7.394
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 61
Number of rings: 4

     

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