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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	CHEMBL3704460
Molecular formula	C20H25F5N6O3S
IUPAC name	2-[7-(diethylamino)-6-ethoxy-3-imino-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]-1-[3-methoxy-5-(pentafluoro-lambda6-sulfanyl)phenyl]ethanone
Molecular weight	524.511
Hydrogen bond acceptor	12
Hydrogen bond donor	1
XlogP	5.9
Synonyms	BDBM169630 SCHEMBL10204917 US9079906, 84
Inchi Key	AHMFKJAKYMDCSX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H25F5N6O3S/c1-5-29(6-2)16-11-18-27-30(20(26)31(18)28-19(16)34-7-3)12-17(32)13-8-14(33-4)10-15(9-13)35(21,22,23,24)25/h8-11,26H,5-7,12H2,1-4H3
PubChem CID	58046026
ChEMBL	CHEMBL3704460
IUPHAR	N/A
BindingDB	169630
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
459271	Proteinase-activated receptor 1	P25116	F2R	Homo sapiens (Human)	425

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