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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	cid_654562
Molecular formula	C19H20N4O2S
IUPAC name	1'-acetyl-4-imino-11,13-dimethylspiro[3-oxa-8-thia-10-azatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraene-6,4'-piperidine]-5-carbonitrile
Molecular weight	368.455
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	2.6
Synonyms	BDBM48916 1-acetyl-2''-amino-7'',9''-dimethyl-3''-spiro[piperidine-4,4''-pyrano[3,4]thieno[1,3-b]pyridine]carbonitrile 2''-azanyl-1-ethanoyl-7'',9''-dimethyl-spiro[piperidine-4,4''-pyrano[3,4]thieno[1,3-b]pyridine]-3''-carbonitrile 1-acetyl-2''-amino-7'',9''-dimethyl-spiro[piperidine-4,4''-pyrano[3,4]thieno[1,3-b]pyridine]-3''-carbonitrile 1-acetyl-2''-amino-7'',9''-dimethylspiro[piperidine-4,4''-pyrano[3,4]thieno[1,3-b]pyridine]-3''-carbonitrile
Inchi Key	AGBGCBNXVPXCIQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H20N4O2S/c1-10-8-11(2)22-18-14(10)15-16(26-18)19(13(9-20)17(21)25-15)4-6-23(7-5-19)12(3)24/h8,13,21H,4-7H2,1-3H3
PubChem CID	91896777
ChEMBL	N/A
IUPHAR	N/A
BindingDB	48916
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
4720	D(1B) dopamine receptor	P21918	DRD5	Homo sapiens (Human)	477

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