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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	CHEMBL404886
Molecular formula	C25H16FN5O2
IUPAC name	8-[2-(4-fluorophenyl)ethynyl]-7-hydroxy-4-[3-(triazol-1-yl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one
Molecular weight	437.434
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	3.6
Synonyms	8-(4-Fluoro-phenylethynyl)-7-hydroxy-4-(3-[1,2,3]triazol-1-yl-phenyl)-1,3-dihydro-benzo[b][1,4]diazepin-2-one BDBM50372868 SCHEMBL7139785
Inchi Key	HHKGHOHNMXZGJC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H16FN5O2/c26-19-8-5-16(6-9-19)4-7-18-13-22-23(14-24(18)32)28-21(15-25(33)29-22)17-2-1-3-20(12-17)31-11-10-27-30-31/h1-3,5-6,8-14,32H,15H2,(H,29,33)
PubChem CID	135544097
ChEMBL	CHEMBL404886
IUPHAR	N/A
BindingDB	50372868
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
560843	Metabotropic glutamate receptor 2	P31421	Grm2	Rattus norvegicus (Rat)	872
560844	Metabotropic glutamate receptor 2	Q14416	GRM2	Homo sapiens (Human)	872
560845	Metabotropic glutamate receptor 8	P70579	Grm8	Rattus norvegicus (Rat)	908

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