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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	CHEMBL205423
Molecular formula	C28H29N7O3
IUPAC name	N-[3-(methylamino)phenyl]-2-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-pyridin-2-yl-1,3,4-benzotriazepin-3-yl]acetamide
Molecular weight	511.586
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	2.9
Synonyms	BDBM50410843 SCHEMBL3910565
Inchi Key	CIKVHFDOFUTQRP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H29N7O3/c1-29-20-9-8-10-21(17-20)31-25(36)18-35-28(38)34(19-26(37)33-15-6-7-16-33)24-13-3-2-11-22(24)27(32-35)23-12-4-5-14-30-23/h2-5,8-14,17,29H,6-7,15-16,18-19H2,1H3,(H,31,36)
PubChem CID	11699148
ChEMBL	CHEMBL205423
IUPHAR	N/A
BindingDB	50410843
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
42770	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447
42771	Gastrin/cholecystokinin type B receptor	P30553	Cckbr	Rattus norvegicus (Rat)	452

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