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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	CHEMBL455699
Molecular formula	C26H25F2N3O2
IUPAC name	1-(2,6-difluorophenyl)-3-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methyl]urea
Molecular weight	449.502
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	4.8
Synonyms	1-(4-[3-(2,6-Difluorophenyl)ureidomethyl]-3-methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine BDBM50246925 SCHEMBL5235385
Inchi Key	BWBKKFRRYWSYQR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H25F2N3O2/c1-17-15-19(25(32)31-14-5-4-8-18-7-2-3-11-23(18)31)12-13-20(17)16-29-26(33)30-24-21(27)9-6-10-22(24)28/h2-3,6-7,9-13,15H,4-5,8,14,16H2,1H3,(H2,29,30,33)
PubChem CID	44563579
ChEMBL	CHEMBL455699
IUPHAR	N/A
BindingDB	50246925
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
34298	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389
34299	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371
34300	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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