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Ligand

NameMLS001029045
Molecular formulaC19H14FN3O5S
IUPAC name2-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-(furan-2-ylmethyl)benzenesulfonamide
Molecular weight415.395
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP1.3
Synonyms2-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-5-fluoro-N-(2-furylmethyl)benzenesulfonamide
AB00857181-06
AKOS001908235
CCG-171217
CHEMBL1492082
[ Show all ]
Inchi KeyCIHQSWNNXNYMMK-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H14FN3O5S/c20-13-6-5-12(11-23-18(24)15-4-1-7-21-17(15)19(23)25)16(9-13)29(26,27)22-10-14-3-2-8-28-14/h1-9,22H,10-11H2
PubChem CID20917809
ChEMBLCHEMBL1492082
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
42693Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
42695Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
42694Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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