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Name | MLS000098536 |
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Molecular formula | C22H23N3O4S |
IUPAC name | 6-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-N-ethyl-N-phenylpyridine-3-sulfonamide |
Molecular weight | 425.503 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | MCULE-5213220430 CHEBI:108166 REGID_for_CID_2998477 6-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-N-ethyl-N-phenyl-pyridine-3-sulfonamide cid_2998477 [ Show all ] |
Inchi Key | BAEWUJRANKALKZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H23N3O4S/c1-2-25(17-8-4-3-5-9-17)30(26,27)19-12-13-22(24-15-19)23-14-18-16-28-20-10-6-7-11-21(20)29-18/h3-13,15,18H,2,14,16H2,1H3,(H,23,24) |
PubChem CID | 2998477 |
ChEMBL | CHEMBL1422284 |
IUPHAR | N/A |
BindingDB | 61410 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
18792 | G-protein coupled receptor 55 | Q9Y2T6 | GPR55 | Homo sapiens (Human) | 319 |
18791 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
18793 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
18794 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
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