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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	MPC-MECA
Molecular formula	C20H24N6O5
IUPAC name	(2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-[(4-methoxyphenyl)methylamino]purin-9-yl]oxolane-2-carboxamide
Molecular weight	428.449
Hydrogen bond acceptor	9
Hydrogen bond donor	4
XlogP	0.6
Synonyms	(2S,3S,4R,5R)-N-ethyl-3,4-dihydroxy-5-[6-[(4-methoxyphenyl)methylamino]purin-9-yl]oxolane-2-carboxamide CHEMBL2113610 BNXGNSTUSRFBCI-KSVNGYGVSA-N D07ZQB Adenosine, N(6)-4-methoxybenzyl-4'-N-ethylcarbamoyl-4'-dehydroxymethyl- 5'-Ethylamino-N-(4-methoxybenzyl)-5'-oxo-5'-deoxyadenosine GTPL460 BDBM50453540 [ Show all ]
Inchi Key	BNXGNSTUSRFBCI-KSVNGYGVSA-N
Inchi ID	InChI=1S/C20H24N6O5/c1-3-21-19(29)16-14(27)15(28)20(31-16)26-10-25-13-17(23-9-24-18(13)26)22-8-11-4-6-12(30-2)7-5-11/h4-7,9-10,14-16,20,27-28H,3,8H2,1-2H3,(H,21,29)(H,22,23,24)/t14-,15+,16-,20+/m0/s1
PubChem CID	10432715
ChEMBL	CHEMBL2113610
IUPHAR	460
BindingDB	50453540
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
28517	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
28519	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320
553403	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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