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Name | CHEMBL3949632 |
---|---|
Molecular formula | C18H22ClF2N3O2S |
IUPAC name | 4-[1-(4-chlorophenyl)-2,2-difluoroethyl]-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine |
Molecular weight | 417.9 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | SCHEMBL15549273 4-(1-(4-Chlorophenyl)-2,2-difluoroethyl)-1-((3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl)piperidine US9475795, 111 BDBM250632 KSXBFKHWLTYGHZ-UHFFFAOYSA-N |
Inchi Key | KSXBFKHWLTYGHZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H22ClF2N3O2S/c1-11-17(12(2)23-22-11)27(25,26)24-9-7-14(8-10-24)16(18(20)21)13-3-5-15(19)6-4-13/h3-6,14,16,18H,7-10H2,1-2H3,(H,22,23) |
PubChem CID | 72548146 |
ChEMBL | CHEMBL3949632 |
IUPHAR | N/A |
BindingDB | 250632 |
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 |
---|---|---|---|---|---|
540529 | Prokineticin receptor 1 | Q8TCW9 | PROKR1 | Homo sapiens (Human) | 393 |
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