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Name | AC1MVU2C |
---|---|
Molecular formula | C19H27ClFN3O3S |
IUPAC name | N-[(2-chloro-4-fluorophenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide |
Molecular weight | 431.951 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.7 |
Synonyms | MCULE-8722734812 N-(2-chloro-4-fluorobenzyl)-1-[(4-methylpiperidin-1-yl)sulfonyl]piperidine-4-carboxamide UNM000000890601 MLS001031087 N-[(2-chloro-4-fluorophenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide [ Show all ] |
Inchi Key | AFDLYVOVJSFPIL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H27ClFN3O3S/c1-14-4-8-23(9-5-14)28(26,27)24-10-6-15(7-11-24)19(25)22-13-16-2-3-17(21)12-18(16)20/h2-3,12,14-15H,4-11,13H2,1H3,(H,22,25) |
PubChem CID | 3688968 |
ChEMBL | CHEMBL1874298 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
463379 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218