COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525328
Chemical Name: (2,5-dimethoxyphenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
Smiles: COc1ccc(cc1C(=O)c1c(C)oc2c1c([N+](=O)[O-])c(c(c2)[N+](=O)[O-])O)OC

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Molecular Weight: 402.32
Empirical Formula: C18H14N2O9

Physical State: Dry powder
Available Amount: 246 mg

Lipinsky:
logP: 3.934
Rotatable bonds: 5
H-donors: 1
H-acceptors: 9
PSA: 160
Number of rings: 3

     

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