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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	CHEMBL160930
Molecular formula	C32H28N2O7
IUPAC name	methyl 2-(2,2-diphenylacetyl)-6-methoxy-5-(4-nitrophenoxy)-3,4-dihydro-1H-isoquinoline-3-carboxylate
Molecular weight	552.583
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	5.8
Synonyms	BDBM50282397 CTLDUBFDLUTHIK-UHFFFAOYSA-N 2-Diphenylacetyl-6-methoxy-5-(4-nitro-phenoxy)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid methyl ester (RS)-2-(Diphenylacetyl)-1,2,3,4-tetrahydro-6-methoxy-5-(4-nitrophenoxy)-3-isoquinolinecarboxylic acid, methyl ester
Inchi Key	CTLDUBFDLUTHIK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H28N2O7/c1-39-28-18-13-23-20-33(31(35)29(21-9-5-3-6-10-21)22-11-7-4-8-12-22)27(32(36)40-2)19-26(23)30(28)41-25-16-14-24(15-17-25)34(37)38/h3-18,27,29H,19-20H2,1-2H3
PubChem CID	15230315
ChEMBL	CHEMBL160930
IUPHAR	N/A
BindingDB	50282397
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
50207	Type-2 angiotensin II receptor	P50052	AGTR2	Homo sapiens (Human)	363

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