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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	CHEMBL1782985
Molecular formula	C22H29Cl2N3O3
IUPAC name	methyl 9-[2-(3,4-dichlorophenyl)acetyl]-2-pyrrolidin-1-yl-7,9-diazabicyclo[4.2.2]decane-7-carboxylate
Molecular weight	454.392
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.8
Synonyms	BDBM50346472 rel-(1RS,2RS,6SR)-methyl9-[2-(3,4-Dichlorophenyl)acetyl]-2-(pyrrolidin-1-yl)-7,9-diaza-bicyclo[4.2.2]decane-7-carboxylate rel-(1RS,2SR,6SR)-methyl9-[2-(3,4-Dichlorophenyl)acetyl]-2-(pyrrolidin-1-yl)-7,9-diaza-bicyclo[4.2.2]decane-7-carboxylate
Inchi Key	AXYUYAKZZNNKDG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H29Cl2N3O3/c1-30-22(29)26-14-20-19(25-9-2-3-10-25)6-4-5-16(26)13-27(20)21(28)12-15-7-8-17(23)18(24)11-15/h7-8,11,16,19-20H,2-6,9-10,12-14H2,1H3
PubChem CID	54585192
ChEMBL	CHEMBL1782985
IUPHAR	N/A
BindingDB	50346472
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
17228	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
17227	Kappa-type opioid receptor	P41144	OPRK1	Cavia porcellus (Guinea pig)	380
17229	Mu-type opioid receptor	P97266	OPRM1	Cavia porcellus (Guinea pig)	98

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