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Name | CHEMBL3732825 |
---|---|
Molecular formula | C28H26ClFN6O5S |
IUPAC name | N-[7-(2-chloro-4-fluoroanilino)-6-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylpropanamide |
Molecular weight | 613.061 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 3.4 |
Synonyms | SCHEMBL15915754 |
Inchi Key | UKIVTEZOYVBILR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H26ClFN6O5S/c1-2-24(37)34-42(39,40)23-15-32-36-25(33-22-8-7-18(30)13-21(22)29)19(14-31-26(23)36)27(38)35-11-9-28(10-12-35)20-6-4-3-5-17(20)16-41-28/h3-8,13-15,33H,2,9-12,16H2,1H3,(H,34,37) |
PubChem CID | 90313089 |
ChEMBL | CHEMBL3732825 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
531009 | C-C chemokine receptor type 10 | P46092 | CCR10 | Homo sapiens (Human) | 362 |
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