You can:
Name | CHEMBL60096 |
---|---|
Molecular formula | C27H33N3O4 |
IUPAC name | N-[4-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]butyl]acetamide |
Molecular weight | 463.578 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 3.0 |
Synonyms | N-(4-{4-[4-(2-Oxo-3,4-dihydro-2H-quinolin-1-yl)-piperidine-1-carbonyl]-phenoxy}-butyl)-acetamide SCHEMBL7294905 BDBM50045134 |
Inchi Key | DVMXTWCHCARTQS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H33N3O4/c1-20(31)28-16-4-5-19-34-24-11-8-22(9-12-24)27(33)29-17-14-23(15-18-29)30-25-7-3-2-6-21(25)10-13-26(30)32/h2-3,6-9,11-12,23H,4-5,10,13-19H2,1H3,(H,28,31) |
PubChem CID | 14969552 |
ChEMBL | CHEMBL60096 |
IUPHAR | N/A |
BindingDB | 50045134 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
70070 | Vasopressin V1a receptor | P30560 | Avpr1a | Rattus norvegicus (Rat) | 424 |
70069 | Vasopressin V2 receptor | Q00788 | Avpr2 | Rattus norvegicus (Rat) | 371 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417