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Name | SMR000091760 |
---|---|
Molecular formula | C20H15N5O3S |
IUPAC name | 2-[1-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl]isoindole-1,3-dione |
Molecular weight | 405.432 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 0 |
XlogP | 2.8 |
Synonyms | 2-{[3-(4-methoxyphenyl)-1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl]ethyl}ben zo[c]azoline-1,3-dione cid_4246341 Oprea1_668724 AC1N75F9 MCULE-8481413604 [ Show all ] |
Inchi Key | ABAGTJARVQFMJH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H15N5O3S/c1-11(24-18(26)14-5-3-4-6-15(14)19(24)27)17-23-25-16(21-22-20(25)29-17)12-7-9-13(28-2)10-8-12/h3-11H,1-2H3 |
PubChem CID | 4246341 |
ChEMBL | CHEMBL1360426 |
IUPHAR | N/A |
BindingDB | 42483 |
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 |
---|---|---|---|---|---|
687 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
685 | Neuropeptide Y receptor type 1 | P25929 | NPY1R | Homo sapiens (Human) | 384 |
686 | Neuropeptide Y receptor type 2 | P49146 | NPY2R | Homo sapiens (Human) | 381 |
463028 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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