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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	CHEMBL1629846
Molecular formula	C25H20F3N3O
IUPAC name	4-[3-(6-cyclopropylpyridin-3-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one
Molecular weight	435.45
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.8
Synonyms	SCHEMBL6489436 4-(3-(6-cyclopropylpyridin-3-yl)phenyl)-7-methyl-8-(trifluoromethyl)-1H-benzo[b][1,4]diazepin-2(3H)-one BDBM50332979 4-[3-(6-Cyclopropyl-pyridin-3-yl)-phenyl]-7-methyl-8-trifluoromethyl-1,3-dihydro-benzo[b][1,4]diazepin-2-one BRXZXJKYSSGQAH-UHFFFAOYSA-N
Inchi Key	BRXZXJKYSSGQAH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H20F3N3O/c1-14-9-22-23(11-19(14)25(26,27)28)31-24(32)12-21(30-22)17-4-2-3-16(10-17)18-7-8-20(29-13-18)15-5-6-15/h2-4,7-11,13,15H,5-6,12H2,1H3,(H,31,32)
PubChem CID	22317728
ChEMBL	CHEMBL1629846
IUPHAR	N/A
BindingDB	50332979
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
31462	Metabotropic glutamate receptor 2	P31421	Grm2	Rattus norvegicus (Rat)	872
558240	Metabotropic glutamate receptor 2	Q14416	GRM2	Homo sapiens (Human)	872

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