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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	MLS000624282
Molecular formula	C19H21N7O3S
IUPAC name	ethyl 4-[2-[(3-pyridin-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetyl]piperazine-1-carboxylate
Molecular weight	427.483
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	0.8
Synonyms	AKOS024612674 MolPort-003-077-426 ethyl 4-(2-((3-(pyridin-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetyl)piperazine-1-carboxylate 868967-19-5 MCULE-8593592513 SMR000323594 F1835-0129 AB00579159-06 CHEMBL1313100 ZINC9599793 HMS2726B03 [ Show all ]
Inchi Key	AHQLWEBMCWXDCA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N7O3S/c1-2-29-19(28)25-11-9-24(10-12-25)17(27)13-30-16-7-6-15-21-22-18(26(15)23-16)14-5-3-4-8-20-14/h3-8H,2,9-13H2,1H3
PubChem CID	16194904
ChEMBL	CHEMBL1313100
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
5804	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757

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