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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	ICIG 864
Molecular formula	C21H22N2O
IUPAC name	1-benzyl-3-(1H-indol-3-ylmethyl)piperidin-4-one
Molecular weight	318.42
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	3.3
Synonyms	AC1MI95D N-Benzyl-3-(3'-indolyl)methyl-4-piperidone 1-Benzyl-3-(1H-indol-3-ylmethyl)-piperidin-4-one ICIG-864 BDBM50283960 1-benzyl-3-(1H-indol-3-ylmethyl)piperidin-4-one CHEMBL151990 52336-92-2 LS-117216 BRN 0831147 4-Piperidinone, 1-benzyl-3-(1H-indol-3-ylmethyl)- [ Show all ]
Inchi Key	YDRMUTOHCRZGCL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H22N2O/c24-21-10-11-23(14-16-6-2-1-3-7-16)15-18(21)12-17-13-22-20-9-5-4-8-19(17)20/h1-9,13,18,22H,10-12,14-15H2
PubChem CID	3040489
ChEMBL	CHEMBL151990
IUPHAR	N/A
BindingDB	50283960
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
407614	Cholecystokinin receptor type A	P30551	Cckar	Rattus norvegicus (Rat)	444
407616	Neuromedin-K receptor	P30098	TACR3	Cavia porcellus (Guinea pig)	440
407615	Substance-K receptor	P51144	TACR2	Mesocricetus auratus (Golden hamster)	384

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