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Name | LZ0EU1YHCK |
---|---|
Molecular formula | C25H28ClN3O2 |
IUPAC name | [6-chloro-1-[2-(dimethylamino)ethyl]indol-3-yl]-spiro[1H-2-benzofuran-3,4'-piperidine]-1'-ylmethanone |
Molecular weight | 437.968 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 3.3 |
Synonyms | RO 5028442 CHEMBL3416885 HY-12981 SCHEMBL4361592 (6-Chloro-1-(2-(dimethylamino)ethyl)indol-3-yl)-spiro(1H-isobenzofuran-3,4'-piperidine)-1'-yl-methanone [ Show all ] |
Inchi Key | QZXVLRCMAHJVIP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H28ClN3O2/c1-27(2)13-14-29-16-21(20-8-7-19(26)15-23(20)29)24(30)28-11-9-25(10-12-28)22-6-4-3-5-18(22)17-31-25/h3-8,15-16H,9-14,17H2,1-2H3 |
PubChem CID | 59657596 |
ChEMBL | CHEMBL3416885 |
IUPHAR | N/A |
BindingDB | 50077217 |
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 |
---|---|---|---|---|---|
453199 | Vasopressin V1a receptor | P37288 | AVPR1A | Homo sapiens (Human) | 418 |
453200 | Vasopressin V1a receptor | Q62463 | Avpr1a | Mus musculus (Mouse) | 423 |
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