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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL51985
Molecular formula	C27H41N2O4+
IUPAC name	4-(7,9-dioxo-8-azaspiro[4.5]decan-8-yl)butyl-(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-methyl-propylazanium
Molecular weight	457.635
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	4.6
Synonyms	BDBM50036872 [4-(7,9-Dioxo-8-aza-spiro[4.5]dec-8-yl)-butyl]-(5-methoxy-chroman-3-yl)-methyl-propyl-ammonium; iodide CHEMBL1178971
Inchi Key	JKDNPVDWERGGAV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H41N2O4/c1-4-15-29(2,21-17-22-23(32-3)10-9-11-24(22)33-20-21)16-8-7-14-28-25(30)18-27(19-26(28)31)12-5-6-13-27/h9-11,21H,4-8,12-20H2,1-3H3/q+1
PubChem CID	10008463
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50036872
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
152920	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
152915	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
152917	5-hydroxytryptamine receptor 2A	Q75Z89	HTR2A	Bos taurus (Bovine)	470
152921	Alpha-1A adrenergic receptor	P18130	ADRA1A	Bos taurus (Bovine)	466
152918	Alpha-2A adrenergic receptor	Q28838	ADRA2A	Bos taurus (Bovine)	452
152919	D(1A) dopamine receptor	Q95136	DRD1	Bos taurus (Bovine)	446
152916	D(2) dopamine receptor	P20288	DRD2	Bos taurus (Bovine)	444

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