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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	CHEMBL426786
Molecular formula	C26H32N2O3
IUPAC name	2-[2-[4-(1-butylindol-3-yl)piperidin-1-yl]ethoxy]benzoic acid
Molecular weight	420.553
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.7
Synonyms	SCHEMBL6781923 2-{2-[4-(1-Butyl-1H-indol-3-yl)-piperidin-1-yl]-ethoxy}-benzoic acid BDBM50156873 NKNYSGLYIJGMTP-UHFFFAOYSA-N 2-{2-[4-(1-butyl-1H-indol-3-yl)piperidin-1-yl]ethoxy}-benzoic acid
Inchi Key	NKNYSGLYIJGMTP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H32N2O3/c1-2-3-14-28-19-23(21-8-4-6-10-24(21)28)20-12-15-27(16-13-20)17-18-31-25-11-7-5-9-22(25)26(29)30/h4-11,19-20H,2-3,12-18H2,1H3,(H,29,30)
PubChem CID	9802248
ChEMBL	CHEMBL426786
IUPHAR	N/A
BindingDB	50156873
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
225678	Histamine H1 receptor	P31389	HRH1	Cavia porcellus (Guinea pig)	488
225679	Histamine H1 receptor	P70174	Hrh1	Mus musculus (Mouse)	488
225677	Histamine H2 receptor	P25021	HRH2	Homo sapiens (Human)	359

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