ciproxifan   Click here for help

GtoPdb Ligand ID: 1265

Synonyms: FUB-359 | FUB359
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 7
Topological polar surface area 54.98
Molecular weight 270.14
XLogP 2.2
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1
Isomeric SMILES O=C(c1ccc(cc1)OCCCc1[nH]cnc1)C1CC1
InChI InChI=1S/C16H18N2O2/c19-16(12-3-4-12)13-5-7-15(8-6-13)20-9-1-2-14-10-17-11-18-14/h5-8,10-12H,1-4,9H2,(H,17,18)
InChI Key ACQBHJXEAYTHCY-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
cyclopropyl-[4-[3-(3H-imidazol-4-yl)propoxy]phenyl]methanone
Synonyms Click here for help
FUB-359 | FUB359
Database Links Click here for help
BindingDB Ligand 27213
CAS Registry No. 184025-18-1 (source: Scifinder)
ChEMBL Ligand CHEMBL14638
GtoPdb PubChem SID 135650102
PubChem CID 6422124
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Wikipedia Ciproxifan