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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	CHEMBL1171102
Molecular formula	C28H22FN5O4
IUPAC name	(2R)-N-[3-[3-cyano-6-(4-fluoro-2-hydroxyphenyl)-2-(furan-2-carbonylamino)pyridin-4-yl]phenyl]pyrrolidine-2-carboxamide
Molecular weight	511.513
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	4.0
Synonyms	N-(3-{3-Cyano-6-(4-fluoro-2-hydroxyphenyl)-2-[(furan-2-ylcarbonyl)amino]pyridin-4-yl}phenyl)-D-prolinamide SCHEMBL13802016 BDBM50322294
Inchi Key	AQCSYEQEMDPBSA-JOCHJYFZSA-N
Inchi ID	InChI=1S/C28H22FN5O4/c29-17-8-9-19(24(35)13-17)23-14-20(21(15-30)26(33-23)34-28(37)25-7-3-11-38-25)16-4-1-5-18(12-16)32-27(36)22-6-2-10-31-22/h1,3-5,7-9,11-14,22,31,35H,2,6,10H2,(H,32,36)(H,33,34,37)/t22-/m1/s1
PubChem CID	136016489
ChEMBL	CHEMBL1171102
IUPHAR	N/A
BindingDB	50322294
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
557623	KiSS-1 receptor	Q969F8	KISS1R	Homo sapiens (Human)	398

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