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Name | CHEMBL3731832 |
---|---|
Molecular formula | C32H34ClN7O6S |
IUPAC name | 1-[7-(2-chloro-5-methylanilino)-6-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonyl-3-(oxan-4-yl)urea |
Molecular weight | 680.177 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 3 |
XlogP | 4.0 |
Synonyms | SCHEMBL15915350 |
Inchi Key | FRQWNRPBELEKIX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H34ClN7O6S/c1-20-6-7-25(33)26(16-20)37-28-23(30(41)39-12-10-32(11-13-39)24-5-3-2-4-21(24)19-46-32)17-34-29-27(18-35-40(28)29)47(43,44)38-31(42)36-22-8-14-45-15-9-22/h2-7,16-18,22,37H,8-15,19H2,1H3,(H2,36,38,42) |
PubChem CID | 90312778 |
ChEMBL | CHEMBL3731832 |
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 |
---|---|---|---|---|---|
524014 | C-C chemokine receptor type 10 | P46092 | CCR10 | Homo sapiens (Human) | 362 |
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