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Name | CHEMBL3409110 |
---|---|
Molecular formula | C29H32FNO2 |
IUPAC name | (4aS,9aR)-2-[2-(4-fluorophenyl)ethyl]-4a-(4-phenylbutyl)-1,3,4,9a-tetrahydro-[1]benzofuro[2,3-c]pyridin-6-ol |
Molecular weight | 445.578 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 7.1 |
Synonyms | BDBM50072345 |
Inchi Key | AAGKZYYLJCIWKQ-VMPREFPWSA-N |
Inchi ID | InChI=1S/C29H32FNO2/c30-24-11-9-23(10-12-24)15-18-31-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(32)13-14-27(26)33-28(29)21-31/h1-3,6-7,9-14,20,28,32H,4-5,8,15-19,21H2/t28-,29-/m0/s1 |
PubChem CID | 118731415 |
ChEMBL | CHEMBL3409110 |
IUPHAR | N/A |
BindingDB | 50072345 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
441673 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
441674 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
441672 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
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