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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	AC1NAH0H
Molecular formula	C20H26N6O5
IUPAC name	8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-7-(3-hydroxypropyl)-1,3-dimethylpurine-2,6-dione
Molecular weight	430.465
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	-0.6
Synonyms	AB00854314-06 MolPort-002-646-581 8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-7-(3-hydroxypropyl)-1,3-dimethylpurine-2,6-dione STK852376 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione MCULE-5350916084 SMR000622863 8-{[4-(2-furoyl)piperazin-1-yl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione CHEMBL1607800 UPCMLD0ENAT5837489:001 851941-56-5 MLS000912912 AKOS001373293 ST51072923 8-{[4-(2-furylcarbonyl)piperazinyl]methyl}-7-(3-hydroxypropyl)-1,3-dimethyl-1, 3,7-trihydropurine-2,6-dione HMS2958I06 ZINC20533474 [ Show all ]
Inchi Key	GRYSAZLBFFFFJN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H26N6O5/c1-22-17-16(19(29)23(2)20(22)30)26(6-4-11-27)15(21-17)13-24-7-9-25(10-8-24)18(28)14-5-3-12-31-14/h3,5,12,27H,4,6-11,13H2,1-2H3
PubChem CID	4426797
ChEMBL	CHEMBL1607800
IUPHAR	N/A
BindingDB	N/A
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
103902	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
103904	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
103903	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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