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Name | CHEMBL3586030 |
---|---|
Molecular formula | C29H30N4O6 |
IUPAC name | 2-(1,3-benzodioxol-5-ylmethylamino)-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-[(1S,5R)-8-oxa-3-azabicyclo[3.2.1]octan-3-yl]pyridine-3-carboxamide |
Molecular weight | 530.581 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 4.2 |
Synonyms | BDBM50094226 |
Inchi Key | BILKSVCFTGINAF-BDTNDASRSA-N |
Inchi ID | InChI=1S/C29H30N4O6/c34-29(32-13-22-16-35-24-3-1-2-4-26(24)39-22)23-10-19(33-14-20-6-7-21(15-33)38-20)12-31-28(23)30-11-18-5-8-25-27(9-18)37-17-36-25/h1-5,8-10,12,20-22H,6-7,11,13-17H2,(H,30,31)(H,32,34)/t20-,21+,22-/m0/s1 |
PubChem CID | 122180024 |
ChEMBL | CHEMBL3586030 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
465940 | Growth hormone secretagogue receptor type 1 | O08725 | Ghsr | Rattus norvegicus (Rat) | 364 |
465941 | Growth hormone secretagogue receptor type 1 | Q92847 | GHSR | Homo sapiens (Human) | 366 |
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