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Name | CHEMBL3326360 |
---|---|
Molecular formula | C21H23NO5 |
IUPAC name | 3-[(1S,3S,4S,6R,7S)-6-(3-methoxyphenyl)-3,6-dimethyl-2,5,8-trioxa-10-azatricyclo[5.2.1.04,10]decan-3-yl]phenol |
Molecular weight | 369.417 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.7 |
Synonyms | BDBM50101309 |
Inchi Key | CNHQLXJWTWVSSF-FCMAGTKHSA-N |
Inchi ID | InChI=1S/C21H23NO5/c1-20(14-7-5-9-16(11-14)24-3)18-22-17(12-25-18)26-21(2,19(22)27-20)13-6-4-8-15(23)10-13/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1 |
PubChem CID | 118711585 |
ChEMBL | CHEMBL3326360 |
IUPHAR | N/A |
BindingDB | 50101309 |
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 |
---|---|---|---|---|---|
443484 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
443485 | Kappa-type opioid receptor | P41144 | OPRK1 | Cavia porcellus (Guinea pig) | 380 |
443486 | Mu-type opioid receptor | P42866 | Oprm1 | Mus musculus (Mouse) | 398 |
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