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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	CHEMBL3921525
Molecular formula	C25H33F3N6O
IUPAC name	3-[4-[(2,4-difluorophenyl)-fluoromethyl]piperidin-1-yl]-N,N-dimethyl-2-(propan-2-ylamino)-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-6-carboxamide
Molecular weight	490.575
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	3.6
Synonyms	US9181249, 72 BDBM190959 BJKRRQIZQPWPHY-UHFFFAOYSA-N SCHEMBL16818279 3-(4-((2,4-difluorophenyl)fluoromethyl)piperidin-1-yl)-2-(isopropylamino)-N,N-dimethyl-7,8-dihydropyrido[3,4-b]pyrazine-6(5H)-carboxamide
Inchi Key	BJKRRQIZQPWPHY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H33F3N6O/c1-15(2)29-23-24(31-21-14-34(25(35)32(3)4)12-9-20(21)30-23)33-10-7-16(8-11-33)22(28)18-6-5-17(26)13-19(18)27/h5-6,13,15-16,22H,7-12,14H2,1-4H3,(H,29,30)
PubChem CID	118159294
ChEMBL	CHEMBL3921525
IUPHAR	N/A
BindingDB	190959
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
536633	G-protein coupled receptor 6	P46095	GPR6	Homo sapiens (Human)	362

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