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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	CHEMBL389711
Molecular formula	C32H37N5O5
IUPAC name	2-[6-[[2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,3,4-benzotriazepin-3-yl]acetyl]amino]indol-1-yl]acetic acid
Molecular weight	571.678
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	5.0
Synonyms	BDBM50411344 L022195 SCHEMBL3910671
Inchi Key	NMRHHKUTBQFJAA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H37N5O5/c1-32(2,3)27(38)18-36-25-12-8-7-11-24(25)30(22-9-5-4-6-10-22)34-37(31(36)42)19-28(39)33-23-14-13-21-15-16-35(20-29(40)41)26(21)17-23/h7-8,11-17,22H,4-6,9-10,18-20H2,1-3H3,(H,33,39)(H,40,41)
PubChem CID	16732164
ChEMBL	CHEMBL389711
IUPHAR	N/A
BindingDB	50411344
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
227158	Cholecystokinin receptor type A	P32238	CCKAR	Homo sapiens (Human)	428
227159	Gastrin/cholecystokinin type B receptor	P30553	Cckbr	Rattus norvegicus (Rat)	452
227160	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447
227161	Gastrin/cholecystokinin type B receptor	P30552	CCKBR	Canis lupus familiaris (Dog)	453

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