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Ligand

NameA-349821
Molecular formulaC26H34N2O3
IUPAC name[4-[4-[3-[(2S,5S)-2,5-dimethylpyrrolidin-1-yl]propoxy]phenyl]phenyl]-morpholin-4-ylmethanone
Molecular weight422.569
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.4
SynonymsA-349,821
CHEMBL27979
BDBM50370569
Inchi KeyCFUHKRLMDNFZED-SFTDATJTSA-N
Inchi IDInChI=1S/C26H34N2O3/c1-20-4-5-21(2)28(20)14-3-17-31-25-12-10-23(11-13-25)22-6-8-24(9-7-22)26(29)27-15-18-30-19-16-27/h6-13,20-21H,3-5,14-19H2,1-2H3/t20-,21-/m0/s1
PubChem CID44275807
ChEMBLCHEMBL27979
IUPHARN/A
BindingDB50370569
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
40991Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
40990D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467
40995Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
40996Histamine H2 receptorP25021HRH2Homo sapiens (Human)359
40989Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
40992Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
40998Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390
40993Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
40994Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
40997Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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