COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL200142
Chemical Name: 3-(4-bromophenoxy)-7-(2,4-dinitrophenoxy)-2-methyl-4H-chromen-4-one
Smiles: Brc1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 513.26
Empirical Formula: C22H13BrN2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.553
Rotatable bonds: 3
H-donors: 0
H-acceptors: 8
PSA: 136
Number of rings: 4

     

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