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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	MRS-4062
Molecular formula	C18H26N3O15P3
IUPAC name	[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[2-oxo-4-(3-phenylpropoxyamino)pyrimidin-1-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight	617.333
Hydrogen bond acceptor	15
Hydrogen bond donor	7
XlogP	-3.7
Synonyms	BDBM50345486 N4-Phenylpropoxycytidine-5''-triphosphate [[(2R,3S,4R,5R)-3,4-dihydroxy-5-[2-oxo-4-(3-phenylpropoxyamino)pyrimidin-1-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate D06PIW N4-phenylpropoxycytidine-5'-triphosphate GTPL4044 MRS4062 CHEMBL1784894 ZINC71294960 MRS 4062 [ Show all ]
Inchi Key	FAYLMQPZASAIOS-MWQQHZPXSA-N
Inchi ID	InChI=1S/C18H26N3O15P3/c22-15-13(11-33-38(28,29)36-39(30,31)35-37(25,26)27)34-17(16(15)23)21-9-8-14(19-18(21)24)20-32-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,13,15-17,22-23H,4,7,10-11H2,(H,28,29)(H,30,31)(H,19,20,24)(H2,25,26,27)/t13-,15-,16-,17-/m1/s1
PubChem CID	53262902
ChEMBL	CHEMBL1784894
IUPHAR	4044
BindingDB	50345486
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
73967	P2Y purinoceptor 2	P41231	P2RY2	Homo sapiens (Human)	377
73968	P2Y purinoceptor 4	P51582	P2RY4	Homo sapiens (Human)	365
73966	P2Y purinoceptor 6	Q15077	P2RY6	Homo sapiens (Human)	328

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