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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	CHEMBL3342860
Molecular formula	C27H32F3N3O4
IUPAC name	[3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]-[4-(trifluoromethyl)phenyl]methanone
Molecular weight	519.565
Hydrogen bond acceptor	9
Hydrogen bond donor	0
XlogP	3.9
Synonyms	BDBM50099444
Inchi Key	AEOKAVWIADBGHU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H32F3N3O4/c1-35-24-5-3-2-4-23(24)32-16-14-31(15-17-32)18-22-19-36-26(37-22)10-12-33(13-11-26)25(34)20-6-8-21(9-7-20)27(28,29)30/h2-9,22H,10-19H2,1H3
PubChem CID	118716707
ChEMBL	CHEMBL3342860
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
441850	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
441849	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
441854	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466
441852	Alpha-1B adrenergic receptor	P15823	Adra1b	Rattus norvegicus (Rat)	515
441853	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
441851	Alpha-1D adrenergic receptor	P23944	Adra1d	Rattus norvegicus (Rat)	561
441855	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572

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