COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681970
Chemical Name: 3-[6-(2-hydroxyethoxy)-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl]propanoicacid
Smiles: OCCOC1=CCC2(CC1(CN(C2)CCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 345.31
Empirical Formula: C13H19N3O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.156
Rotatable bonds: 8
H-donors: 2
H-acceptors: 8
PSA: 161
Number of rings: 2

     

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