General Information of the Compound
| Compound ID |
CP0241967
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[8-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]octyl]-1-[(4-methoxyphenyl)methyl]-4-oxoquinoline-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C39H43ClN4O3
|
||||||||||||||||||
| Molecular Weight |
651.251
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(Cn2cc(C(=O)NCCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)c(=O)c3ccccc23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C39H43ClN4O3/c1-47-29-19-16-27(17-20-29)25-44-26-33(38(45)32-13-7-9-15-36(32)44)39(46)42-23-11-5-3-2-4-10-22-41-37-30-12-6-8-14-34(30)43-35-24-28(40)18-21-31(35)37/h7,9,13,15-21,24,26H,2-6,8,10-12,14,22-23,25H2,1H3,(H,41,43)(H,42,46)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OBXCJDDMEPVENQ-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