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Ligand

NameCHEMBL1086514
Molecular formulaC27H27N3O
IUPAC name1-[4-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]quinolin-2-yl]phenyl]pyridin-4-one
Molecular weight409.533
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.0
Synonyms1-(4-[6-{2-((2R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-quinolin-2-yl}-phenyl)-1H-pyridin-4-one
1-(4-{6-[2-((2R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-quinolin-2-yl}-phenyl)-1H-pyridin-4-one
SCHEMBL1575300
AFPODXVEPNVDCE-HXUWFJFHSA-N
BDBM50319538
[ Show all ]
Inchi KeyAFPODXVEPNVDCE-HXUWFJFHSA-N
Inchi IDInChI=1S/C27H27N3O/c1-20-3-2-15-29(20)16-12-21-4-10-27-23(19-21)7-11-26(28-27)22-5-8-24(9-6-22)30-17-13-25(31)14-18-30/h4-11,13-14,17-20H,2-3,12,15-16H2,1H3/t20-/m1/s1
PubChem CID11531634
ChEMBLCHEMBL1086514
IUPHARN/A
BindingDB50319538
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
4378Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
4379Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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