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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	CHEMBL227330
Molecular formula	C32H38N4O5
IUPAC name	3-[3-[[2-[5-cyclohexyl-1-(2-cyclopentyl-2-oxoethyl)-2-oxo-1,3,4-benzotriazepin-3-yl]acetyl]amino]phenyl]propanoic acid
Molecular weight	558.679
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	5.1
Synonyms	SCHEMBL3913222 BDBM50411336 L022199
Inchi Key	NNOLAMDMDMSDDD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H38N4O5/c37-28(23-10-4-5-11-23)20-35-27-16-7-6-15-26(27)31(24-12-2-1-3-13-24)34-36(32(35)41)21-29(38)33-25-14-8-9-22(19-25)17-18-30(39)40/h6-9,14-16,19,23-24H,1-5,10-13,17-18,20-21H2,(H,33,38)(H,39,40)
PubChem CID	16733466
ChEMBL	CHEMBL227330
IUPHAR	N/A
BindingDB	50411336
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
227848	Cholecystokinin receptor type A	P32238	CCKAR	Homo sapiens (Human)	428
227849	Gastrin/cholecystokinin type B receptor	P30553	Cckbr	Rattus norvegicus (Rat)	452
227850	Gastrin/cholecystokinin type B receptor	P30552	CCKBR	Canis lupus familiaris (Dog)	453
227851	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447

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