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Name | AC1M7E9L |
---|---|
Molecular formula | C16H14Cl2N2O4 |
IUPAC name | [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate |
Molecular weight | 369.198 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.3 |
Synonyms | MLS001005447 SR-01000041404-1 CHEMBL1497919 SMR000384007 [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 1-oxidopyridin-1-ium-4-carboxylate [ Show all ] |
Inchi Key | AGAZPUIIICAUIR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H14Cl2N2O4/c17-13-2-1-11(14(18)9-13)3-6-19-15(21)10-24-16(22)12-4-7-20(23)8-5-12/h1-2,4-5,7-9H,3,6,10H2,(H,19,21) |
PubChem CID | 2416447 |
ChEMBL | CHEMBL1497919 |
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 |
---|---|---|---|---|---|
463460 | 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