General Information of the Compound
| Compound ID |
CP0382203
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6,7-dimethoxy-2-[[5-(4-methoxyphenyl)furan-2-yl]methyl]-3,4-dihydro-1H-isoquinoline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H25NO4
|
||||||||||||||||||
| Molecular Weight |
379.456
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1ccc(CN2CCc3cc(OC)c(OC)cc3C2)o1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H25NO4/c1-25-19-6-4-16(5-7-19)21-9-8-20(28-21)15-24-11-10-17-12-22(26-2)23(27-3)13-18(17)14-24/h4-9,12-13H,10-11,14-15H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
XNIABEBXQZEDDQ-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound