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Name | CHEMBL3981546 |
---|---|
Molecular formula | C17H21Cl2N3O3S |
IUPAC name | 4-[(3,4-dichlorophenyl)methyl]-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-ol |
Molecular weight | 418.333 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 3.1 |
Synonyms | CMJKATYDVFCLFG-UHFFFAOYSA-N SCHEMBL15549108 4-(3,4-Dichlorobenzyl)-1-((3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl)piperidin-4-ol US9475795, 70 BDBM250591 |
Inchi Key | CMJKATYDVFCLFG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H21Cl2N3O3S/c1-11-16(12(2)21-20-11)26(24,25)22-7-5-17(23,6-8-22)10-13-3-4-14(18)15(19)9-13/h3-4,9,23H,5-8,10H2,1-2H3,(H,20,21) |
PubChem CID | 72550670 |
ChEMBL | CHEMBL3981546 |
IUPHAR | N/A |
BindingDB | 250591 |
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 |
---|---|---|---|---|---|
534105 | Prokineticin receptor 1 | Q8TCW9 | PROKR1 | Homo sapiens (Human) | 393 |
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