General Information of the Compound
| Compound ID |
CP0045649
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| Compound Name |
(REV-5,901)1-[3-(Quinolin-2-ylmethoxy)-phenyl]-hexan-1-ol
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| Synonyms |
1-(3-(quinolin-2-ylmethoxy)phenyl)hexan-1-ol
1-[3-(quinolin-2-ylmethoxy)phenyl]hexan-1-ol
101910-24-1
AC1L1JIU
ACMC-20d0wb
BSPBio_001522
Benzenemethanol, alpha-pentyl-3-(2-quinolinylmethoxy)-
CBiol_001910
CHEMBL8747
KBioGR_000242
KBioSS_000242
Lopac0_001042
MLS000069771
MLS001076522
Opera_ID_512
PF 5901
PF-5901
REV-5901
REV-901
RG 5901
Rev 5901
SMR000058509
SR-01000076105
UNII-WNW5RYD8MG
WNW5RYD8MG
alpha-Pentyl-3-(2-quinolinylmethoxy)benzenemethanol
alpha-Pentyl-3-[2-quinolinylmethoxy]benzyl alcohol
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| Structure |
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| Formula |
C22H25NO2
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| Molecular Weight |
335.447
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| Canonical SMILES |
CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1
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| InChI |
InChI=1S/C22H25NO2/c1-2-3-4-12-22(24)18-9-7-10-20(15-18)25-16-19-14-13-17-8-5-6-11-21(17)23-19/h5-11,13-15,22,24H,2-4,12,16H2,1H3
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| InChIKey |
JRLOEMCOOZSCQP-UHFFFAOYSA-N
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| CAS |
101910-24-1
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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: PT01800, Cysteinyl leukotriene receptor 1
Protein ID: PT02509, G-protein coupled bile acid receptor 1
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT01743, Polyunsaturated fatty acid 5-lipoxygenase
Clinical Information about the Compound