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Ligand

NameCHEMBL453654
Molecular formulaC25H29N3O3
IUPAC name2-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-6-methoxy-3-methylquinazolin-4-one
Molecular weight419.525
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.0
SynonymsSCHEMBL2003145
6-Methoxy-3-methyl-2-[4-(1-cyclobutyl-4-piperidinyloxy)-phenyl]-4(3H)-quinazolinone
2-(4-(1-cyclobutylpiperidin-4-yloxy)phenyl)-6-methoxy-3-methylquinazolin-4(3H)-one
AKNFPZICZLISBZ-UHFFFAOYSA-N
BDBM50246333
Inchi KeyAKNFPZICZLISBZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H29N3O3/c1-27-24(26-23-11-10-21(30-2)16-22(23)25(27)29)17-6-8-19(9-7-17)31-20-12-14-28(15-13-20)18-4-3-5-18/h6-11,16,18,20H,3-5,12-15H2,1-2H3
PubChem CID11502638
ChEMBLCHEMBL453654
IUPHARN/A
BindingDB50246333
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
7712Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
7711Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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