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Name | 3,6-dichloro-1-benzothiophene-2-carboxylic acid |
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Molecular formula | C9H4Cl2O2S |
IUPAC name | 3,6-dichloro-1-benzothiophene-2-carboxylic acid |
Molecular weight | 247.089 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | 34576-94-8 ALBB-000952 EN300-00845 MLS000777260 ST45138818 [ Show all ] |
Inchi Key | AAHPIJMQJAZYTM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C9H4Cl2O2S/c10-4-1-2-5-6(3-4)14-8(7(5)11)9(12)13/h1-3H,(H,12,13) |
PubChem CID | 739884 |
ChEMBL | CHEMBL1448105 |
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 |
---|---|---|---|---|---|
215 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
214 | Vasopressin V1b receptor | P47901 | AVPR1B | Homo sapiens (Human) | 424 |
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