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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	SMR000020474
Molecular formula	C22H20N4O6
IUPAC name	3-[4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-oxo-[1,2,4]triazino[2,3-a]benzimidazol-2-yl]propanoic acid
Molecular weight	436.424
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	1.9
Synonyms	MLS001368028 3-{4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-oxo-3,4-dihydro[1,2,4]triazino[2,3-a]benzimidazol-2-yl}propanoic acid HMS1490L09 SR-01000114415-1 CCG-25017 IDI1_024145 CHEMBL1609563 AC1MMVL5 HMS2154P04 CHEBI:111432 MLS000085539 3-[4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-oxo-[1,2,4]triazino[2,3-a]benzimidazol-2-yl]propanoic acid ChemDiv3_006235 SR-01000114415 BRD-K91117991-001-01-6 HMS3318P22 [ Show all ]
Inchi Key	AEWZLQMPHQVZPN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H20N4O6/c1-31-18-9-7-13(11-19(18)32-2)17(27)12-25-21(30)15(8-10-20(28)29)24-26-16-6-4-3-5-14(16)23-22(25)26/h3-7,9,11H,8,10,12H2,1-2H3,(H,28,29)
PubChem CID	3245113
ChEMBL	CHEMBL1609563
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
463359	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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