VUF 5207   Click here for help

GtoPdb Ligand ID: 1245

Synonyms: VUF-5207 | VUF5207
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 31.92
Molecular weight 181.16
XLogP 0.95
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN(CCCCCc1[nH]cnc1)C
Isomeric SMILES CN(CCCCCc1[nH]cnc1)C
InChI InChI=1S/C10H19N3/c1-13(2)7-5-3-4-6-10-8-11-9-12-10/h8-9H,3-7H2,1-2H3,(H,11,12)
InChI Key MVHBNHUOEFGIBK-UHFFFAOYSA-N
References
1. Wieland K, Bongers G, Yamamoto Y, Hashimoto T, Yamatodani A, Menge WM, Timmerman H, Lovenberg TW, Leurs R. (2001)
Constitutive activity of histamine h(3) receptors stably expressed in SK-N-MC cells: display of agonism and inverse agonism by H(3) antagonists.
J Pharmacol Exp Ther, 299 (3): 908-14. [PMID:11714875]