General Information of the Compound
| Compound ID |
CP0552541
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-(3,4-dimethoxyphenyl)furan-2-yl]methanone
Show/Hide
|
||||||||||||||||||
| Formula |
C24H25NO6
|
||||||||||||||||||
| Molecular Weight |
423.465
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1OC)-c1ccc(o1)C(=O)N1CCc2cc(OC)c(OC)cc2C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H25NO6/c1-27-19-6-5-16(12-21(19)28-2)18-7-8-20(31-18)24(26)25-10-9-15-11-22(29-3)23(30-4)13-17(15)14-25/h5-8,11-13H,9-10,14H2,1-4H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
WJXIDNYWFVVJCA-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 | |||||||||||||||||||
| 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