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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	CHEMBL1171977
Molecular formula	C27H22FN5O4
IUPAC name	N-[3-cyano-4-[3-[[2-(dimethylamino)acetyl]amino]phenyl]-6-(4-fluoro-2-hydroxyphenyl)pyridin-2-yl]furan-2-carboxamide
Molecular weight	499.502
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	4.0
Synonyms	N-[3-Cyano-4-{3-[(N,N-dimethylglycyl)amino]phenyl}-6-(4-fluoro-2-hydroxyphenyl)pyridin-2-yl]furan-2-carboxamide BDBM50322295
Inchi Key	HYCGCNWUUVRFCO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H22FN5O4/c1-33(2)15-25(35)30-18-6-3-5-16(11-18)20-13-22(19-9-8-17(28)12-23(19)34)31-26(21(20)14-29)32-27(36)24-7-4-10-37-24/h3-13,34H,15H2,1-2H3,(H,30,35)(H,31,32,36)
PubChem CID	136016490
ChEMBL	CHEMBL1171977
IUPHAR	N/A
BindingDB	50322295
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
561238	KiSS-1 receptor	Q924U1	Kiss1r	Rattus norvegicus (Rat)	396
561239	KiSS-1 receptor	Q969F8	KISS1R	Homo sapiens (Human)	398

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