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Name | AC1ME3YV |
---|---|
Molecular formula | C14H20N2O2 |
IUPAC name | 5,6-dimethyl-8-(2-methylprop-1-enyl)-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione |
Molecular weight | 248.326 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 2 |
XlogP | 1.6 |
Synonyms | BAS 00459067 SMR000140419 5,6-dimethyl-8-(2-methyl-1-propen-1-yl)-2,3,4a,5,8,8a-hexahydro-1,4-phthalazinedione CHEMBL1459997 STL300806 [ Show all ] |
Inchi Key | AGFYVJCJRQPJIS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H20N2O2/c1-7(2)5-10-6-8(3)9(4)11-12(10)14(18)16-15-13(11)17/h5-6,9-12H,1-4H3,(H,15,17)(H,16,18) |
PubChem CID | 2847622 |
ChEMBL | CHEMBL1459997 |
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 |
---|---|---|---|---|---|
4845 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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