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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	CHEMBL67026
Molecular formula	C19H17N7O2
IUPAC name	4-[3-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]propyl]phenol
Molecular weight	375.392
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	2.4
Synonyms	4-[3-(5-Amino-2-furan-2-yl-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)-propyl]-phenol MolPort-042-665-849 AKOS032945684 SCHEMBL8128711 2-(2-Furyl)-6-[3-(4-hydroxyphenyl)propyl]-6H-1,3,3a,5,6,7-hexaaza-as-indacene-4-amine 5-amino-7-[3-(4-hydroxyphenyl)propyl]-2-(2-furyl)pyrazolo[4,3-e]1,2,4-triazolo[1,5-c]pyrimidine NCGC00386744-01 BDBM50064700 TL80090036 4-(3-(5-amino-2-(furan-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)propyl)phenol L016341 Phenol, 4-[3-[5-amino-2-(2-furanyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl]propyl]- ZINC841354 [ Show all ]
Inchi Key	AXDUXMMFIPBLRQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H17N7O2/c20-19-23-17-14(18-22-16(24-26(18)19)15-4-2-10-28-15)11-21-25(17)9-1-3-12-5-7-13(27)8-6-12/h2,4-8,10-11,27H,1,3,9H2,(H2,20,23)
PubChem CID	10362099
ChEMBL	CHEMBL67026
IUPHAR	N/A
BindingDB	50064700
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
16588	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
16592	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
16589	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
16590	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
16591	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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