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Ligand

Name5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-N-isopropyl-2-methoxybenzenesulfonamide
Molecular formulaC18H19N3O5S
IUPAC name5-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxy-N-propan-2-ylbenzenesulfonamide
Molecular weight389.426
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.4
SynonymsAKOS001951799
CHEMBL1562552
HMS2870F23
MCULE-7445367718
MLS001199938
[ Show all ]
Inchi KeyBBAUGPSFIADKMT-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19N3O5S/c1-11(2)20-27(24,25)15-9-12(6-7-14(15)26-3)10-21-17(22)13-5-4-8-19-16(13)18(21)23/h4-9,11,20H,10H2,1-3H3
PubChem CID20923142
ChEMBLCHEMBL1562552
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
19344Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
19345Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
19346Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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