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Name | CHEMBL270969 |
---|---|
Molecular formula | C29H33N3O4 |
IUPAC name | [9-[[2-(2-methoxyphenoxy)phenyl]methyl]-3,9-diazaspiro[5.5]undecan-3-yl]-(1-oxidopyridin-1-ium-2-yl)methanone |
Molecular weight | 487.6 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 3.8 |
Synonyms | BDBM50423495 SCHEMBL4182586 |
Inchi Key | BEWXCKHNNXXEFC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H33N3O4/c1-35-26-11-4-5-12-27(26)36-25-10-3-2-8-23(25)22-30-18-13-29(14-19-30)15-20-31(21-16-29)28(33)24-9-6-7-17-32(24)34/h2-12,17H,13-16,18-22H2,1H3 |
PubChem CID | 11950827 |
ChEMBL | CHEMBL270969 |
IUPHAR | N/A |
BindingDB | 50423495 |
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 |
---|---|---|---|---|---|
22002 | C-C chemokine receptor type 8 | P51685 | CCR8 | Homo sapiens (Human) | 355 |
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