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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	CHEMBL518675
Molecular formula	C26H22ClF3N4O4
IUPAC name	(2S)-2-[[1-(7-chloroquinolin-4-yl)-5-[2-(trifluoromethoxy)phenyl]pyrazole-3-carbonyl]amino]-4-methylpentanoic acid
Molecular weight	546.931
Hydrogen bond acceptor	9
Hydrogen bond donor	2
XlogP	6.6
Synonyms	BDBM50248140 (2S)-2-(1-(7-chloroquinolin-4-yl)-5-(2-(trifluoromethoxy)phenyl)-1H-pyrazole-3-carboxamido)-4-methylpentanoic acid
Inchi Key	AWBJCBBPHILPEC-FQEVSTJZSA-N
Inchi ID	InChI=1S/C26H22ClF3N4O4/c1-14(2)11-20(25(36)37)32-24(35)19-13-22(17-5-3-4-6-23(17)38-26(28,29)30)34(33-19)21-9-10-31-18-12-15(27)7-8-16(18)21/h3-10,12-14,20H,11H2,1-2H3,(H,32,35)(H,36,37)/t20-/m0/s1
PubChem CID	44157044
ChEMBL	CHEMBL518675
IUPHAR	N/A
BindingDB	50248140
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
15863	Neurotensin receptor type 1	P30989	NTSR1	Homo sapiens (Human)	418

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