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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	316173-57-6
Molecular formula	C20H19N7O2
IUPAC name	4-(furan-2-yl)-10-[3-(4-methoxyphenyl)propyl]-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine
Molecular weight	389.419
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.7
Synonyms	2-(Furan-2-yl)-7-(3-(4-methoxyphenyl)propyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ami ACM316173576 BRD-K46469693-001-01-8 GTPL3283 SCH 442416 ZINC602847 ANW-62570 CHEMBL136689 KB-224078 SCH-442416, >=98% (HPLC) 2-(2-FURANYL)-7-[3-(4-METHOXYPHENYL)PROPYL]-7H-PYRAZOLO[4,3-E][1,2,4]TRIAZOLO[1,5-C]PYRIMIDIN-5-AMINE BCP01942 DTXSID70443263 NCGC00159575-01 SCHEMBL981184 2-(Furan-2-yl)-7-(3-(4-methoxyphenyl)propyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine AJ-23684 CHEBI:92814 HMS3269G07 SCH-442,416 ZMC4G1W59S 2-(2-Furanyl)-7-[3-(4-methoxyphenyl)propyl]-7H-pyrazolo [4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine; 5-amino-7-(3-(4-methoxyphenyl)propyl)-2-(2 furyl)pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine AX8233433 CTK8B9468 MFCD08703126 SCH442,416 2-(Furan-2-yl)-7-(3-(4-methoxyphenyl)propyl)-7H-pyrazolo-[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine AC-27414 BDBM50094037 FT-0701417 RT-015675 UNII-ZMC4G1W59S 2-Furan-2-yl-7-[3-(4-methoxy-phenyl)-propyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-ylamine AKOS016003924 J-018496 SCH-442416 2-(2-Furanyl)-7-[3-(4-methoxyphenyl)propyl]-7H-pyrazolo [4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine; 5-amino-7-(3-(4-methoxyphenyl)propyl)-2-(2 furyl)pyrazolo[4,3-e]-1,2,4-triazolo[1,5-c]pyrimidine; 5-Amino-7-[3-(4-methoxy)phenylpropyl]-2-(2-furyl)-pyr 4-(furan-2-yl)-10-[3-(4-methoxyphenyl)propyl]-3,5,6,8,10,11-hexaazatricyclo[7.3.0.0^{2,6}]dodeca-1(9),2,4,7,11-pentaen-7-amine B7065 D02YQO MolPort-023-276-442 SCH442416 [ Show all ]
Inchi Key	AEULVFLPCJOBCE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H19N7O2/c1-28-14-8-6-13(7-9-14)4-2-10-26-18-15(12-22-26)19-23-17(16-5-3-11-29-16)25-27(19)20(21)24-18/h3,5-9,11-12H,2,4,10H2,1H3,(H2,21,24)
PubChem CID	10668061
ChEMBL	CHEMBL136689
IUPHAR	3283
BindingDB	50094037
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
3855	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
3860	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
3853	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
3859	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
3856	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
3854	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318
3857	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320
3858	Adenosine receptor A3	Q0VC81	ADORA3	Bos taurus (Bovine)	317

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