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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	MLS002320750
Molecular formula	C27H28ClNO4
IUPAC name	(4R,4aS,6E,12bS)-6-benzylidene-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;hydrochloride
Molecular weight	465.974
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	None
Synonyms	7-Benzylidene-7-dehydronaltrexone (BNTX) hydrochloride SMR001338896 CHEMBL1521291
Inchi Key	AHCJSCIBHORNDI-LCFORMMBSA-N
Inchi ID	InChI=1S/C27H27NO4.ClH/c29-20-9-8-18-13-21-27(31)14-19(12-16-4-2-1-3-5-16)23(30)25-26(27,22(18)24(20)32-25)10-11-28(21)15-17-6-7-17;/h1-5,8-9,12,17,21,25,29,31H,6-7,10-11,13-15H2;1H/b19-12+;/t21-,25?,26+,27-;/m1./s1
PubChem CID	44246746
ChEMBL	CHEMBL1521291
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	Partition coefficient log P of this ligand is not available.

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
5432	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
463540	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593
5431	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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