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Name | CHEMBL2418739 |
---|---|
Molecular formula | C18H23NO3 |
IUPAC name | (4R,4aR,6R,7S,7aR,12bS)-3,6-dimethyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol |
Molecular weight | 301.386 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 2.3 |
Synonyms | SCHEMBL16698289 |
Inchi Key | DSQWJPSUVUVXPZ-CHBFXNIQSA-N |
Inchi ID | InChI=1S/C18H23NO3/c1-9-7-11-12-8-10-3-4-13(20)16-14(10)18(11,5-6-19(12)2)17(22-16)15(9)21/h3-4,9,11-12,15,17,20-21H,5-8H2,1-2H3/t9-,11+,12-,15+,17+,18+/m1/s1 |
PubChem CID | 71819401 |
ChEMBL | CHEMBL2418739 |
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 |
---|---|---|---|---|---|
67882 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
67878 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
67881 | Kappa-type opioid receptor | P33534 | Oprk1 | Mus musculus (Mouse) | 380 |
67879 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
67880 | Mu-type opioid receptor | P42866 | Oprm1 | Mus musculus (Mouse) | 398 |
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