COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL325171
Chemical Name: (4-bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
Smiles: Brc1ccc(cc1)C(=O)c1c(C)oc2c1c([N+](=O)[O-])c(c(c2)[N+](=O)[O-])O

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Molecular Weight: 421.16
Empirical Formula: C16H9BrN2O7

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 4.688
Rotatable bonds: 2
H-donors: 1
H-acceptors: 7
PSA: 142
Number of rings: 3

     

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