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Ligand

NameCHEMBL1089390
Molecular formulaC17H27N5
IUPAC name4-[(3R)-3-(methylamino)pyrrolidin-1-yl]spiro[6,7-dihydro-5H-quinazoline-8,1'-cyclopentane]-2-amine
Molecular weight301.438
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsSCHEMBL3818902
KTIHAAVUVHUODX-GFCCVEGCSA-N
BDBM50415769
(R)-4'-(3-(methylamino)pyrrolidin-1-yl)-6',7'-dihydro-5'H-spiro[cyclopentane-1,8'-quinazolin]-2'-amine
Inchi KeyKTIHAAVUVHUODX-GFCCVEGCSA-N
Inchi IDInChI=1S/C17H27N5/c1-19-12-6-10-22(11-12)15-13-5-4-9-17(7-2-3-8-17)14(13)20-16(18)21-15/h12,19H,2-11H2,1H3,(H2,18,20,21)/t12-/m1/s1
PubChem CID44231735
ChEMBLCHEMBL1089390
IUPHARN/A
BindingDB50415769
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
177756Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
177757Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
177754Histamine H4 receptorQ91ZY1Hrh4Rattus norvegicus (Rat)391
177755Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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