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Name | CHEMBL1098825 |
---|---|
Molecular formula | C21H23FN6O |
IUPAC name | (1-amino-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-(4-fluorophenyl)methanone |
Molecular weight | 394.454 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.9 |
Synonyms | 7-(4-Fluorobenzoyl)-5-(piperidin-1-yl)-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridin-1-ylamine BDBM50317457 |
Inchi Key | RTRVVHLTJHRRNU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H23FN6O/c22-14-6-4-13(5-7-14)21(29)28-11-8-15-16(12-28)20(27-9-2-1-3-10-27)24-19-17(15)18(23)25-26-19/h4-7H,1-3,8-12H2,(H3,23,24,25,26) |
PubChem CID | 46887979 |
ChEMBL | CHEMBL1098825 |
IUPHAR | N/A |
BindingDB | 50317457 |
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 |
---|---|---|---|---|---|
304907 | Bombesin receptor subtype-3 | P32247 | BRS3 | Homo sapiens (Human) | 399 |
304908 | Bombesin receptor subtype-3 | Q8K418 | Brs3 | Rattus norvegicus (Rat) | 399 |
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