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Name | SMR000091841 |
---|---|
Molecular formula | C14H16N4O2S |
IUPAC name | 7-amino-4-oxo-5-propan-2-yl-2-prop-2-enylsulfanyl-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile |
Molecular weight | 304.368 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.1 |
Synonyms | AC1NDRL2 MLS000114455 2-(allylthio)-7-amino-5-isopropyl-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile CCG-22730 7-amino-4-oxo-5-(propan-2-yl)-2-(prop-2-en-1-ylsulfanyl)-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile [ Show all ] |
Inchi Key | CYZJXPVUZCVQGI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H16N4O2S/c1-4-5-21-14-17-12(19)10-9(7(2)3)8(6-15)11(16)20-13(10)18-14/h4,7,9H,1,5,16H2,2-3H3,(H,17,18,19) |
PubChem CID | 4605879 |
ChEMBL | CHEMBL1578918 |
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 |
---|---|---|---|---|---|
54100 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
54101 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
469593 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
54098 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
54097 | Relaxin receptor 2 | Q8WXD0 | RXFP2 | Homo sapiens (Human) | 754 |
54099 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
54096 | Vasopressin V1b receptor | P47901 | AVPR1B | Homo sapiens (Human) | 424 |
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