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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	Ap3A
Molecular formula	C20H27N10O16P3
IUPAC name	bis[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
Molecular weight	756.411
Hydrogen bond acceptor	24
Hydrogen bond donor	9
XlogP	-7.2
Synonyms	Adenosine (5')triphospho(5')adenosine BDBM50184368 DB01690 P1,P3-Bis(5'-adenosyl) triphosphate Adenosine(3)triphosphate adenosine C06197 P(1),P(3)-bis(5''-adenosyl) trihydrogen triphosphate A(5')p3(5')A CHEMBL407938 P(1),P(3)-bis(5'-adenosyl) triphosphate Adenosine 5'-(tetrahydrogen triphosphate), P''-5'-ester with adenosine BIS(ADENOSINE)-5'-TRIPHOSPHATE diadenosine triphosphate SCHEMBL1744586 5959-90-0 adenosine(5'')triphospho(5'')adenosine CHEBI:27775 P(1),P(3)-bis(5''-adenosyl) triphosphate AC1L4WLI ApppA D0S5GU P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate 5'Ap3A Adenosine 5'-triphosphate 5'-adenosine bis[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate LS-15178 ZINC8220358 A(5'')p3(5'')A adenosine(5')triphospho(5')adenosine P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate [ Show all ]
Inchi Key	QCICUPZZLIQAPA-XPWFQUROSA-N
Inchi ID	InChI=1S/C20H27N10O16P3/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(43-19)1-41-47(35,36)45-49(39,40)46-48(37,38)42-2-8-12(32)14(34)20(44-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
PubChem CID	165381
ChEMBL	CHEMBL407938
IUPHAR	N/A
BindingDB	50184368
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

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
274839	P2Y purinoceptor 1	P49651	P2ry1	Rattus norvegicus (Rat)	373

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