COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK331218
Chemical Name: 2-(1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)pentanedioicacid
Smiles: OC(=O)CCC(N1CC2(CC=CC(C1)(C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)O

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Molecular Weight: 343.29
Empirical Formula: C13H17N3O8

Available Amount: 0 mg

Lipinsky:
logP: 1.451
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 169
Number of rings: 2

     

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