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Ligand

NameCHEMBL1085560
Molecular formulaC24H26N4
IUPAC name2,6-dimethyl-5-[6-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]quinolin-2-yl]pyridine-3-carbonitrile
Molecular weight370.5
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.5
SynonymsABCLYDOXFRWKNB-MRXNPFEDSA-N
2,6-dimethyl-5-(6-{2-[(2R)-2-methyl-1-pyrrolidinyl]ethyl}-2-quinolinyl)nicotinonitrile
BDBM50319514
SCHEMBL1641115
(R)-2,6-dimethyl-5-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinolin-2-yl)nicotinonitrile
Inchi KeyABCLYDOXFRWKNB-MRXNPFEDSA-N
Inchi IDInChI=1S/C24H26N4/c1-16-5-4-11-28(16)12-10-19-6-8-23-20(13-19)7-9-24(27-23)22-14-21(15-25)17(2)26-18(22)3/h6-9,13-14,16H,4-5,10-12H2,1-3H3/t16-/m1/s1
PubChem CID46890475
ChEMBLCHEMBL1085560
IUPHARN/A
BindingDB50319514
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
737Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
738Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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