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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	CHEMBL288178
Molecular formula	C23H25ClN2O4
IUPAC name	N-[(4aS,7aR)-3-(cyclopropylmethyl)-9-hydroxy-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-2-chloroprop-2-enamide
Molecular weight	428.913
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.3
Synonyms	BDBM50287334 1N-[4-cyclopropylmethyl-10-hydroxy-14-oxo-(13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-17-yl]-2-chloroacrylamide
Inchi Key	MVSBLZZXOLNTIU-NGCYQRTHSA-N
Inchi ID	InChI=1S/C23H25ClN2O4/c1-12(24)21(29)25-23-7-6-16(28)20-22(23)8-9-26(11-13-2-3-13)17(23)10-14-4-5-15(27)19(30-20)18(14)22/h4-5,13,17,20,27H,1-3,6-11H2,(H,25,29)/t17?,20-,22?,23+/m0/s1
PubChem CID	44286875
ChEMBL	CHEMBL288178
IUPHAR	N/A
BindingDB	50287334
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
215366	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
215367	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
215368	Mu-type opioid receptor	P79350	OPRM1	Bos taurus (Bovine)	401

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