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Name | CHEMBL97518 |
---|---|
Molecular formula | C22H29N3O2 |
IUPAC name | (6aR,9R)-N-[(2R)-2-(hydroxymethyl)-2-methylbutyl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide |
Molecular weight | 367.493 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 2.9 |
Synonyms | 7-Methyl-4,6,6a,7,8,9-hexahydro-indolo[4,3-fg]quinoline-9-carboxylic acid (2-hydroxymethyl-2-methyl-butyl)-amide BDBM50130271 |
Inchi Key | MLGNCAXDEPBXNR-YIFZBPKDSA-N |
Inchi ID | InChI=1S/C22H29N3O2/c1-4-22(2,13-26)12-24-21(27)15-8-17-16-6-5-7-18-20(16)14(10-23-18)9-19(17)25(3)11-15/h5-8,10,15,19,23,26H,4,9,11-13H2,1-3H3,(H,24,27)/t15-,19-,22-/m1/s1 |
PubChem CID | 44327952 |
ChEMBL | CHEMBL97518 |
IUPHAR | N/A |
BindingDB | 50130271 |
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 |
---|---|---|---|---|---|
208300 | 5-hydroxytryptamine receptor 5A | P47898 | HTR5A | Homo sapiens (Human) | 357 |
208302 | 5-hydroxytryptamine receptor 5A | P30966 | Htr5a | Mus musculus (Mouse) | 357 |
208301 | 5-hydroxytryptamine receptor 6 | P50406 | HTR6 | Homo sapiens (Human) | 440 |
208299 | 5-hydroxytryptamine receptor 7 | P32305 | Htr7 | Rattus norvegicus (Rat) | 448 |
208303 | 5-hydroxytryptamine receptor 7 | P34969 | HTR7 | Homo sapiens (Human) | 479 |
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