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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	1023540-34-2
Molecular formula	C21H19Cl2FN2O
IUPAC name	3-chloro-6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Molecular weight	405.294
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	5.6
Synonyms	AC1N2WDX KS-00003P7I 3-chloro-6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one AKOS022169281 MolPort-006-755-354 6-chloro-10-(2-chloro-6-fluorophenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one MS-6617 2,10-diaza-13-chloro-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one [ Show all ]
Inchi Key	GCHDAQVOSYMNLW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H19Cl2FN2O/c1-21(2)9-16-19(17(27)10-21)20(18-12(23)4-3-5-13(18)24)26-15-8-11(22)6-7-14(15)25-16/h3-8,20,25-26H,9-10H2,1-2H3
PubChem CID	4078100
ChEMBL	CHEMBL564193
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
92936	Neuromedin-B receptor	P28336	NMBR	Homo sapiens (Human)	390

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