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Name | AC1N17QH |
---|---|
Molecular formula | C16H14FN5O3S3 |
IUPAC name | 6-amino-5-[2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione |
Molecular weight | 439.498 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 1 |
XlogP | 2.9 |
Synonyms | SMR001239911 CHEMBL1490219 6-amino-5-[2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione MLS002157422 AKOS033942658 [ Show all ] |
Inchi Key | GTOAUYAZMQXOAU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H14FN5O3S3/c1-20-12(18)11(13(24)21(2)15(20)25)10(23)7-27-14-19-22(16(26)28-14)9-5-3-8(17)4-6-9/h3-6H,7,18H2,1-2H3 |
PubChem CID | 4000951 |
ChEMBL | CHEMBL1490219 |
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 |
---|---|---|---|---|---|
475866 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
105017 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
105018 | Relaxin receptor 2 | Q8WXD0 | RXFP2 | Homo sapiens (Human) | 754 |
105019 | Vasopressin V1b receptor | P47901 | AVPR1B | Homo sapiens (Human) | 424 |
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