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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	MLS001030387
Molecular formula	C21H23N3O5S
IUPAC name	N-cyclohexyl-5-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzenesulfonamide
Molecular weight	429.491
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.4
Synonyms	MolPort-007-951-215 ZINC9503542 MCULE-5349668835 AKOS002120968 N-cyclohexyl-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzenesulfonamide CHEMBL1477514 CCG-201142 SMR000635502 HMS2958M04 [ Show all ]
Inchi Key	BMDFDMUDFBRYBQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H23N3O5S/c1-29-17-10-9-14(12-18(17)30(27,28)23-15-6-3-2-4-7-15)13-24-20(25)16-8-5-11-22-19(16)21(24)26/h5,8-12,15,23H,2-4,6-7,13H2,1H3
PubChem CID	20970002
ChEMBL	CHEMBL1477514
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
27359	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
27361	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
27360	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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