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Name | CHEMBL1328077 |
---|---|
Molecular formula | C24H25N3O2S |
IUPAC name | N-[2-(4-methylsulfanylphenyl)ethyl]-4-(4-oxopyrrolo[1,2-a]quinoxalin-5-yl)butanamide |
Molecular weight | 419.543 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.8 |
Synonyms | E228-1471 MolPort-007-729-317 ZINC8588538 HMS1861L15 N-{2-[4-(methylthio)phenyl]ethyl}-4-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide [ Show all ] |
Inchi Key | AEAQKTAUEMPISV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H25N3O2S/c1-30-19-12-10-18(11-13-19)14-15-25-23(28)9-5-17-27-21-7-3-2-6-20(21)26-16-4-8-22(26)24(27)29/h2-4,6-8,10-13,16H,5,9,14-15,17H2,1H3,(H,25,28) |
PubChem CID | 16018192 |
ChEMBL | CHEMBL1328077 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
463278 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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