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Name | CHEMBL3976696 |
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Molecular formula | C17H19ClN4O3S |
IUPAC name | 5-chloro-2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]oxybenzonitrile |
Molecular weight | 394.874 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.7 |
Synonyms | BDBM250555 LVAYTVXWKWKIQK-UHFFFAOYSA-N SCHEMBL15548725 5-Chloro-2-{[1-(3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperidin-4-yl]oxy}benzonitrile US9475795, 34 |
Inchi Key | LVAYTVXWKWKIQK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H19ClN4O3S/c1-11-17(12(2)21-20-11)26(23,24)22-7-5-15(6-8-22)25-16-4-3-14(18)9-13(16)10-19/h3-4,9,15H,5-8H2,1-2H3,(H,20,21) |
PubChem CID | 72549789 |
ChEMBL | CHEMBL3976696 |
IUPHAR | N/A |
BindingDB | 250555 |
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 |
---|---|---|---|---|---|
534787 | Prokineticin receptor 1 | Q8TCW9 | PROKR1 | Homo sapiens (Human) | 393 |
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