General Information of the Compound
| Compound ID |
CP0095254
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
10-methoxy-2,2,4-trimethyl-5-(2-methylbut-3-en-2-yl)-1,5-dihydrochromeno[3,4-f]quinoline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H29NO2
|
||||||||||||||||||
| Molecular Weight |
375.512
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc2OC(c3c(ccc4NC(C)(C)C=C(C)c34)-c12)C(C)(C)C=C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H29NO2/c1-8-24(3,4)23-22-16(21-18(27-7)10-9-11-19(21)28-23)12-13-17-20(22)15(2)14-25(5,6)26-17/h8-14,23,26H,1H2,2-7H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
NAHDBDPHVAZITF-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