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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL522894
Molecular formulaC25H25FN4O2
IUPAC name4-[3-[4-(5-fluoro-2-pyridin-2-ylbenzimidazol-1-yl)phenoxy]propyl]morpholine
Molecular weight432.499
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.8
SynonymsBDBM50264897
SCHEMBL13937095
4-(3-(4-(5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazol-1-yl)phenoxy)propyl)morpholine
Inchi KeyADHCEOHLWFBYCU-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25FN4O2/c26-19-5-10-24-23(18-19)28-25(22-4-1-2-11-27-22)30(24)20-6-8-21(9-7-20)32-15-3-12-29-13-16-31-17-14-29/h1-2,4-11,18H,3,12-17H2
PubChem CID11676381
ChEMBLCHEMBL522894
IUPHARN/A
BindingDB50264897
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
2311Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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