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Name | 3-(3-methoxypropyl)-2-thioxo-2,3-dihydro[1]benzothieno[3,2-d]pyrimidin-4(1H)-one |
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Molecular formula | C14H14N2O2S2 |
IUPAC name | 3-(3-methoxypropyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one |
Molecular weight | 306.398 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | 3-(3-methoxypropyl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one MCULE-3610866904 AKOS002073273 SMR000310613 EU-0094157 [ Show all ] |
Inchi Key | AIPPMMQBZBMGHH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H14N2O2S2/c1-18-8-4-7-16-13(17)12-11(15-14(16)19)9-5-2-3-6-10(9)20-12/h2-3,5-6H,4,7-8H2,1H3,(H,15,19) |
PubChem CID | 5123174 |
ChEMBL | CHEMBL1432655 |
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 |
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6432 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
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