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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	AC1M5D8K
Molecular formula	C19H16N2O6
IUPAC name	[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(2-cyanophenoxy)acetate
Molecular weight	368.345
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.2
Synonyms	SMR001244546 CHEMBL1492960 [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-(2-cyanophenoxy)acetate MLS002162135 AKOS033671043 Z19285136 HMS3074C04 {[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl 2-(2-cyanophenoxy)acetate 436104-98-2 MolPort-004-012-501 ZINC3259550 MCULE-3433296693 [ Show all ]
Inchi Key	AEGGFWNUCDTEEP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H16N2O6/c20-8-14-3-1-2-4-15(14)24-11-19(23)25-10-18(22)21-9-13-5-6-16-17(7-13)27-12-26-16/h1-7H,9-12H2,(H,21,22)
PubChem CID	2376314
ChEMBL	CHEMBL1492960
IUPHAR	N/A
BindingDB	N/A
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
463300	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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