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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	CHEMBL295425
Molecular formula	C31H25F6N3O3
IUPAC name	N-[(2R,4S)-2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]piperidin-4-yl]-2-oxo-1H-quinoline-4-carboxamide
Molecular weight	601.549
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	5.8
Synonyms	BDBM50287416 2-Hydroxy-quinoline-4-carboxylic acid [(2R,4S)-2-benzyl-1-(3,5-bis-trifluoromethyl-benzoyl)-piperidin-4-yl]-amide
Inchi Key	XUVYYIIVCVDGFW-XZOQPEGZSA-N
Inchi ID	InChI=1S/C31H25F6N3O3/c32-30(33,34)20-13-19(14-21(15-20)31(35,36)37)29(43)40-11-10-22(16-23(40)12-18-6-2-1-3-7-18)38-28(42)25-17-27(41)39-26-9-5-4-8-24(25)26/h1-9,13-15,17,22-23H,10-12,16H2,(H,38,42)(H,39,41)/t22-,23+/m0/s1
PubChem CID	44289197
ChEMBL	CHEMBL295425
IUPHAR	N/A
BindingDB	50287416
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
401503	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
401501	Substance-K receptor	P05363	TACR2	Bos taurus (Bovine)	384
401502	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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