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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	CHEMBL593613
Molecular formula	C21H26N4O
IUPAC name	3-[2-(4-tert-butylphenyl)-5-[(dimethylamino)methyl]-1,2,4-triazol-3-yl]phenol
Molecular weight	350.466
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.5
Synonyms	3-(2-(4-tert-Butylphenyl)-5-((dimethylamino)methyl)-2H-1,2,4-triazol-3-yl)phenol BDBM50304076 SCHEMBL14205947
Inchi Key	AFYXROWBOMSTBN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H26N4O/c1-21(2,3)16-9-11-17(12-10-16)25-20(15-7-6-8-18(26)13-15)22-19(23-25)14-24(4)5/h6-13,26H,14H2,1-5H3
PubChem CID	25000426
ChEMBL	CHEMBL593613
IUPHAR	N/A
BindingDB	50304076
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
4640	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
4643	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
4641	Kappa-type opioid receptor	P34975	Oprk1	Rattus norvegicus (Rat)	380
4642	Mu-type opioid receptor	P42866	Oprm1	Mus musculus (Mouse)	398

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