COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380853
Chemical Name: 2-bromo-N-{(1Z)-1-(4-nitrophenyl)-3-oxo-3-[(2-phenylethyl)amino]prop-1-en-2-yl}benzamide
Smiles: O=C(/C(=C/c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccccc1Br)NCCc1ccccc1

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Molecular Weight: 494.34
Empirical Formula: C24H20BrN3O4

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 3.906
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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