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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	CHEMBL3416861
Molecular formula	C21H19ClN2O2
IUPAC name	(6-chloro-1H-indol-3-yl)-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylmethanone
Molecular weight	366.845
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	3.4
Synonyms	1'-[(6-chloro -1H-indol-3-yl)carbonyl]-3H-spiro[2-benzofuran-1,4'-piperidine] BDBM50077206 FPWHCHLKTSMBLA-UHFFFAOYSA-N 1'-[(6-chloro-1H-indol-3-yl)carbonyl]-3H-spiro[2-benzofuran-1,4'-piperidine] SCHEMBL4360122
Inchi Key	FPWHCHLKTSMBLA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H19ClN2O2/c22-15-5-6-16-17(12-23-19(16)11-15)20(25)24-9-7-21(8-10-24)18-4-2-1-3-14(18)13-26-21/h1-6,11-12,23H,7-10,13H2
PubChem CID	15951937
ChEMBL	CHEMBL3416861
IUPHAR	N/A
BindingDB	50077206
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
445052	Oxytocin receptor	P30559	OXTR	Homo sapiens (Human)	389
445053	Vasopressin V1a receptor	P37288	AVPR1A	Homo sapiens (Human)	418
445054	Vasopressin V1a receptor	Q62463	Avpr1a	Mus musculus (Mouse)	423
445055	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371

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