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Name | CHEMBL3416881 |
---|---|
Molecular formula | C25H26ClN3O3 |
IUPAC name | 2-[6-chloro-3-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)indol-1-yl]-N,N-dimethylacetamide |
Molecular weight | 451.951 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 3.0 |
Synonyms | BDBM50077223 SCHEMBL4357766 SCHEMBL4357768 |
Inchi Key | CBGJLAOTFNDRDC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H26ClN3O3/c1-27(2)23(30)15-29-14-20(19-8-7-18(26)13-22(19)29)24(31)28-11-9-25(10-12-28)21-6-4-3-5-17(21)16-32-25/h3-8,13-14H,9-12,15-16H2,1-2H3 |
PubChem CID | 59657523 |
ChEMBL | CHEMBL3416881 |
IUPHAR | N/A |
BindingDB | 50077223 |
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 |
---|---|---|---|---|---|
443184 | Vasopressin V1a receptor | P37288 | AVPR1A | Homo sapiens (Human) | 418 |
443185 | Vasopressin V1a receptor | Q62463 | Avpr1a | Mus musculus (Mouse) | 423 |
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