General Information of the Compound
| Compound ID |
CP0099745
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| Compound Name |
4-[3-(4-cyclopropanecarbonylphenoxy)propyl]-1H-imidazole
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| Synonyms |
(4-(3-(1H-imidazol-4-yl)propoxy)phenyl)(cyclopropyl)methanone
184025-18-1
5EVQ7IRG99
AC1O4Y0P
ACQBHJXEAYTHCY-UHFFFAOYSA-N
BDBM27213
CHEBI:125467
CHEMBL14638
Ciproxifan
Ciproxifan (FUB-359)
DTXSID50171532
EX-A077
FUB 359
FUB-359
FUB359
GTPL1265
Methanone, cyclopropyl(4-(3-(1H-imidazol-5-yl)propoxy)phenyl)-
MolPort-027-720-958
SCHEMBL3335184
UNII-5EVQ7IRG99
ZINC1892860
ciproxifan
cyclopropyl-(4-(3-1H-imidazol-4-yl)propyloxyphenyl)ketone
cyclopropyl-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]methanone
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| Structure |
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| Formula |
C16H18N2O2
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| Molecular Weight |
270.332
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| Canonical SMILES |
O=C(C1CC1)c1ccc(OCCCc2cnc[nH]2)cc1
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| 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)
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| InChIKey |
ACQBHJXEAYTHCY-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a
Protein ID: PT01278, Adenosine receptor A2b
Protein ID: PT01279, Adenosine receptor A3
Protein ID: PT01650, Alpha-2A adrenergic receptor
Protein ID: PT01598, Alpha-2C adrenergic receptor
Protein ID: PT01206, Histamine H1 receptor
Protein ID: PT01173, Histamine H3 receptor
Protein ID: PT01194, Histamine H3 receptor
Cell-based Assay
Protein ID: PT01711, Histamine H4 receptor
Clinical Information about the Compound