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Name | SMR000060129 |
---|---|
Molecular formula | C19H20N2O5 |
IUPAC name | ethyl 5-[5-(2,4-dihydroxy-5-propylphenyl)-1H-pyrazol-4-yl]furan-2-carboxylate |
Molecular weight | 356.378 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 3.8 |
Synonyms | 5-[(3Z)-3-(4-hydroxy-6-keto-3-propyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazolin-4-yl]furan-2-carboxylic acid ethyl ester HMS2488F16 AC1NTFTA ethyl 5-[(3Z)-3-(4-hydroxy-6-oxo-3-propylcyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazol-4-yl]furan-2-carboxylate Oprea1_317137 [ Show all ] |
Inchi Key | HKTSJOVFAVYHKL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H20N2O5/c1-3-5-11-8-12(15(23)9-14(11)22)18-13(10-20-21-18)16-6-7-17(26-16)19(24)25-4-2/h6-10,22-23H,3-5H2,1-2H3,(H,20,21) |
PubChem CID | 984148 |
ChEMBL | CHEMBL1541596 |
IUPHAR | N/A |
BindingDB | 61793 |
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 |
---|---|---|---|---|---|
560937 | Galanin receptor type 3 | O60755 | GALR3 | Homo sapiens (Human) | 368 |
560934 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
560935 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
560936 | Neuropeptide Y receptor type 1 | P25929 | NPY1R | Homo sapiens (Human) | 384 |
560938 | Neuropeptide Y receptor type 2 | P49146 | NPY2R | Homo sapiens (Human) | 381 |
560939 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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