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Ligand

NameCHEMBL1084616
Molecular formulaC21H22N6
IUPAC name6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)quinoline
Molecular weight358.449
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
Synonyms(R)-2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoline
BDBM50319564
SCHEMBL3457090
Inchi KeyAGDVFPLNDDIXBY-OAHLLOKOSA-N
Inchi IDInChI=1S/C21H22N6/c1-15-3-2-10-26(15)11-8-16-4-6-18-17(13-16)5-7-19(24-18)20-9-12-27-21(25-20)22-14-23-27/h4-7,9,12-15H,2-3,8,10-11H2,1H3/t15-/m1/s1
PubChem CID11581252
ChEMBLCHEMBL1084616
IUPHARN/A
BindingDB50319564
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4798Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
4799Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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