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Name | SCHEMBL1704176 |
---|---|
Molecular formula | C27H37FN4O |
IUPAC name | 2-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]-1-[4-(3-fluoroanilino)piperidin-1-yl]propan-1-one |
Molecular weight | 452.618 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.3 |
Synonyms | CHEMBL2364332 |
Inchi Key | HQMIOCCKYFLZIK-WCRBZPEASA-N |
Inchi ID | InChI=1S/C27H37FN4O/c1-19-16-31(17-20(2)29-19)18-22-7-9-23(10-8-22)21(3)27(33)32-13-11-25(12-14-32)30-26-6-4-5-24(28)15-26/h4-10,15,19-21,25,29-30H,11-14,16-18H2,1-3H3/t19-,20+,21? |
PubChem CID | 15984243 |
ChEMBL | CHEMBL2364332 |
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 |
---|---|---|---|---|---|
121520 | Motilin receptor | O43193 | MLNR | Homo sapiens (Human) | 412 |
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