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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	CHEMBL90966
Molecular formula	C27H30N4O4
IUPAC name	7,8-dimethoxy-3-[[4-(quinolin-6-ylmethyl)piperazin-1-yl]methyl]-3a,4-dihydro-3H-chromeno[4,3-c][1,2]oxazole
Molecular weight	474.561
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	3.2
Synonyms	7,8-Dimethoxy-3-(4-quinolin-6-ylmethyl-piperazin-1-ylmethyl)-3a,4-dihydro-3H-chromeno[4,3-c]isoxazole BDBM50131367 SCHEMBL14604922
Inchi Key	APNJYYQXBHETAR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H30N4O4/c1-32-24-13-20-23(14-25(24)33-2)34-17-21-26(35-29-27(20)21)16-31-10-8-30(9-11-31)15-18-5-6-22-19(12-18)4-3-7-28-22/h3-7,12-14,21,26H,8-11,15-17H2,1-2H3
PubChem CID	44325038
ChEMBL	CHEMBL90966
IUPHAR	N/A
BindingDB	50131367
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
11152	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
11151	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
11150	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462

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