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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	CHEMBL1089542
Molecular formula	C25H35N5O
IUPAC name	N-[[3-[(diaminomethylideneamino)methyl]phenyl]methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
Molecular weight	421.589
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	2.7
Synonyms	BDBM50314880 N-(3-(guanidinomethyl)benzyl)-N-(1-phenethylpiperidin-4-yl)propionamide
Inchi Key	AQTLLNFIIZDSEL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H35N5O/c1-2-24(31)30(19-22-10-6-9-21(17-22)18-28-25(26)27)23-12-15-29(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17,23H,2,11-16,18-19H2,1H3,(H4,26,27,28)
PubChem CID	46884841
ChEMBL	CHEMBL1089542
IUPHAR	N/A
BindingDB	50314880
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
12084	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
12087	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
12086	Kappa-type opioid receptor	P41144	OPRK1	Cavia porcellus (Guinea pig)	380
12083	Mu-type opioid receptor	P97266	OPRM1	Cavia porcellus (Guinea pig)	98
12085	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398

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