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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	CHEMBL177386
Molecular formula	C19H19Cl2N9O
IUPAC name	5-N-[[(2R)-1-[(3,5-dichloropyridin-4-yl)methyl]pyrrolidin-2-yl]methyl]-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine
Molecular weight	460.323
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	2.9
Synonyms	BDBM50152218 N5-[(R)-1-(3,5-Dichloro-pyridin-4-ylmethyl)-pyrrolidin-2-ylmethyl]-2-furan-2-yl-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine
Inchi Key	AOKIATHOELUTRB-LLVKDONJSA-N
Inchi ID	InChI=1S/C19H19Cl2N9O/c20-13-8-23-9-14(21)12(13)10-29-5-1-3-11(29)7-24-18-26-17(22)30-19(27-18)25-16(28-30)15-4-2-6-31-15/h2,4,6,8-9,11H,1,3,5,7,10H2,(H3,22,24,25,26,27,28)/t11-/m1/s1
PubChem CID	11155402
ChEMBL	CHEMBL177386
IUPHAR	N/A
BindingDB	50152218
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
10309	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
10308	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410

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