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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	BDBM50030144
Molecular formula	C19H22N2O4S
IUPAC name	N-[(4aS,7aR,12bR)-9-hydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-2-sulfanylacetamide
Molecular weight	374.455
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	1.1
Synonyms	1N-[10-hydroxy-4-methyl-14-oxo-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7,9,11(18)-trien-17-yl]-2-sulfanylacetamide
Inchi Key	IFWCCHXFUMLVAF-IKJNLRRPSA-N
Inchi ID	InChI=1S/C19H22N2O4S/c1-21-7-6-18-15-10-2-3-11(22)16(15)25-17(18)12(23)4-5-19(18,13(21)8-10)20-14(24)9-26/h2-3,13,17,22,26H,4-9H2,1H3,(H,20,24)/t13?,17-,18-,19+/m0/s1
PubChem CID	44287058
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50030144
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
132263	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
132262	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
132261	Mu-type opioid receptor	P79350	OPRM1	Bos taurus (Bovine)	401

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