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Name | 2-(1-Adamantyl)-1-methyl-2-oxoethyl thiocyanate |
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Molecular formula | C14H19NOS |
IUPAC name | [1-(1-adamantyl)-1-oxopropan-2-yl] thiocyanate |
Molecular weight | 249.372 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 3.7 |
Synonyms | HMS1608M05 SR-01000396892-1 AFHOTHXGVBTAHP-UHFFFAOYSA-N MolPort-003-722-102 CHEMBL1544162 [ Show all ] |
Inchi Key | AFHOTHXGVBTAHP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H19NOS/c1-9(17-8-15)13(16)14-5-10-2-11(6-14)4-12(3-10)7-14/h9-12H,2-7H2,1H3 |
PubChem CID | 584851 |
ChEMBL | CHEMBL1544162 |
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 |
---|---|---|---|---|---|
4161 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
463392 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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