General Information of the Compound
| Compound ID |
CP0401234
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(6aS)-9-hexan-2-yloxy-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H35NO4
|
||||||||||||||||||
| Molecular Weight |
425.569
|
||||||||||||||||||
| Canonical SMILES |
CCCCC(C)Oc1cc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(-c2cc1OC)c34
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H35NO4/c1-7-8-9-16(2)31-22-14-18-12-20-24-17(10-11-27(20)3)13-23(29-5)26(30-6)25(24)19(18)15-21(22)28-4/h13-16,20H,7-12H2,1-6H3/t16?,20-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
MWXMHVJMFNQKBH-FZCLLLDFSA-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