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Ligand

NameDonitriptan
Molecular formulaC23H25N5O2
IUPAC name4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile
Molecular weight403.486
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.2
SynonymsEP5
SCHEMBL1388876
1-(((3-(2-Aminoethyl)indol-5-yl)oxy)acetyl)-4-(p-cyanophenyl)piperazine.
ACM170912524
D0G5ML
[ Show all ]
Inchi KeySOHCKWZVTCTQBG-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25N5O2/c24-8-7-18-15-26-22-6-5-20(13-21(18)22)30-16-23(29)28-11-9-27(10-12-28)19-3-1-17(14-25)2-4-19/h1-6,13,15,26H,7-12,16,24H2
PubChem CID197706
ChEMBLN/A
IUPHAR39
BindingDBN/A
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: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5548545-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
5548505-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
5548535-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
5548515-hydroxytryptamine receptor 1DP28565Htr1dRattus norvegicus (Rat)374
5548555-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
5548495-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
5548525-hydroxytryptamine receptor 1FP30939HTR1FHomo sapiens (Human)366
5548465-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5548475-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
5548485-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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