COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292889
Chemical Name: (2E)-2-(4-bromophenyl)-3-{4-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])/c1ccc(cc1)Br

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Molecular Weight: 435.28
Empirical Formula: C22H15BrN2O3

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 6.706
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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