COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK924956
Chemical Name: 3-(4-bromophenyl)-7-[(4-nitrobenzyl)oxy]-4H-chromen-4-one
Smiles: Brc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 452.26
Empirical Formula: C22H14BrNO5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.766
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 4

     

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