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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	MLS001116560
Molecular formula	C21H19N3O6S
IUPAC name	5-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
Molecular weight	441.458
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	1.6
Synonyms	SMR000630009 5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-[(5-methyl-2-furyl)methyl]-1-benzenesulfonamide ZINC9226309 CHEMBL1545457 MolPort-007-771-522 AKOS001554892 HMS2958K18 [ Show all ]
Inchi Key	BCZHYRSLVLVNSI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H19N3O6S/c1-13-5-7-15(30-13)11-23-31(27,28)18-10-14(6-8-17(18)29-2)12-24-20(25)16-4-3-9-22-19(16)21(24)26/h3-10,23H,11-12H2,1-2H3
PubChem CID	20923178
ChEMBL	CHEMBL1545457
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
20711	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
20713	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
20712	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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