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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	CHEMBL325161
Molecular formula	C31H28N4O4
IUPAC name	ethyl (2R)-2-[[(2R)-3-(1H-indol-3-yl)-2-(quinoline-3-carbonylamino)propanoyl]amino]-2-phenylacetate
Molecular weight	520.589
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	4.9
Synonyms	{3-(1H-Indol-3-yl)-2-[(quinoline-3-carbonyl)-amino]-propionylamino}-phenyl-acetic acid ethyl ester (R)-2-[(R)-3-(1H-Indol-3-yl)-2-(3-quinolinylcarbonylamino)propanoylamino]-2-phenylacetic acid ethyl ester BDBM50008630
Inchi Key	BNTFCCSMRNSBKQ-VSGBNLITSA-N
Inchi ID	InChI=1S/C31H28N4O4/c1-2-39-31(38)28(20-10-4-3-5-11-20)35-30(37)27(17-22-18-33-26-15-9-7-13-24(22)26)34-29(36)23-16-21-12-6-8-14-25(21)32-19-23/h3-16,18-19,27-28,33H,2,17H2,1H3,(H,34,36)(H,35,37)/t27-,28-/m1/s1
PubChem CID	15104632
ChEMBL	CHEMBL325161
IUPHAR	N/A
BindingDB	50008630
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
28430	Cholecystokinin receptor type A	Q63931	CCKAR	Cavia porcellus (Guinea pig)	430
28429	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447

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