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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	11-(2-chlorophenyl)-3,3,8-trimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Molecular formula	C22H23ClN2O
IUPAC name	6-(2-chlorophenyl)-3,9,9-trimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Molecular weight	366.889
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	5.2
Synonyms	MCULE-8169345289 AK-968/14004845 STK263645 Cambridge id 5926419 6-(2-chlorophenyl)-3,9,9-trimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one MolPort-002-118-576 AKOS002305313 AC1MEDQA Oprea1_754033 AKOS016320891 [ Show all ]
Inchi Key	IJMYVYYYYRIKRS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H23ClN2O/c1-13-8-9-16-17(10-13)25-21(14-6-4-5-7-15(14)23)20-18(24-16)11-22(2,3)12-19(20)26/h4-10,21,24-25H,11-12H2,1-3H3
PubChem CID	2876782
ChEMBL	CHEMBL564151
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
134766	Neuromedin-B receptor	P28336	NMBR	Homo sapiens (Human)	390

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