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Name | CHEMBL76816 |
---|---|
Molecular formula | C23H32N2O4 |
IUPAC name | 2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-[(2R)-1-hydroxy-3-(3-phenylpropoxy)propan-2-yl]propanamide |
Molecular weight | 400.519 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 4 |
XlogP | 2.5 |
Synonyms | 2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-N-[2-hydroxy-1-(3-phenyl-propoxymethyl)-ethyl]-propionamide BDBM50001845 |
Inchi Key | DLPBBVPHWIOXTJ-LCQOSCCDSA-N |
Inchi ID | InChI=1S/C23H32N2O4/c1-16-11-20(27)12-17(2)21(16)13-22(24)23(28)25-19(14-26)15-29-10-6-9-18-7-4-3-5-8-18/h3-5,7-8,11-12,19,22,26-27H,6,9-10,13-15,24H2,1-2H3,(H,25,28)/t19-,22?/m1/s1 |
PubChem CID | 44314456 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50001845 |
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 |
---|---|---|---|---|---|
63233 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
63234 | Kappa-type opioid receptor | P34975 | Oprk1 | Rattus norvegicus (Rat) | 380 |
63235 | Mu-type opioid receptor | P33535 | Oprm1 | Rattus norvegicus (Rat) | 398 |
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