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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	CHEMBL3581311
Molecular formula	C19H26N10O
IUPAC name	2-[3-(dimethylamino)propyl]-1-ethyl-3-[4-(furan-2-yl)-11-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2,4,7,9-pentaen-7-yl]guanidine
Molecular weight	410.486
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	1.1
Synonyms	1-Ethyl-3-(3-(N,N-dimethylamino)propyl)-2-(2-methyl-9-(2-furyl)-4,5-(iminomethanimino)-4,5-dihydro-2H-pyrazolo[3,4-d]pyrimidine-8,10(4)-diene-6-yl)guanidine BDBM50092309
Inchi Key	AJAAGHYTDBRMNZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H26N10O/c1-5-20-18(21-9-7-10-27(2)3)24-19-23-15-13(12-28(4)25-15)17-22-16(26-29(17)19)14-8-6-11-30-14/h6,8,11-12H,5,7,9-10H2,1-4H3,(H2,20,21,23,24,25)
PubChem CID	122178757
ChEMBL	CHEMBL3581311
IUPHAR	N/A
BindingDB	50092309
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
463670	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
463672	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
463671	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
463669	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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