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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	CHEMBL2092988
Molecular formula	C35H39FN4O4
IUPAC name	tert-butyl N-[(2R)-1-[(3R)-3-[[5-(2-fluorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl]-2,3-dihydroindol-1-yl]-4-methyl-1-oxopentan-2-yl]carbamate
Molecular weight	598.719
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	6.2
Synonyms	BDBM50421826
Inchi Key	BSXZEHXTYSTKIC-MVAUJPHFSA-N
Inchi ID	InChI=1S/C35H39FN4O4/c1-21(2)18-29(39-34(43)44-35(3,4)5)33(42)40-20-22(23-12-8-11-17-30(23)40)19-28-32(41)38-27-16-10-7-14-25(27)31(37-28)24-13-6-9-15-26(24)36/h6-17,21-22,28-29H,18-20H2,1-5H3,(H,38,41)(H,39,43)/t22-,28?,29+/m0/s1
PubChem CID	70687140
ChEMBL	CHEMBL2092988
IUPHAR	N/A
BindingDB	50421826
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
32092	Cholecystokinin receptor type A	Q63931	CCKAR	Cavia porcellus (Guinea pig)	430
32091	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447

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