General Information of the Compound
| Compound ID |
CP0535134
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-cyclohexyl-2-methoxy-3-(4-methylpiperazin-1-yl)-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H31N5O2
|
||||||||||||||||||
| Molecular Weight |
469.589
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2c(cc1N1CCN(C)CC1)n(C1CCCCC1)c1[nH]c3cc(ccc3c1c2=O)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H31N5O2/c1-31-10-12-32(13-11-31)24-16-23-21(15-25(24)35-2)27(34)26-20-9-8-18(17-29)14-22(20)30-28(26)33(23)19-6-4-3-5-7-19/h8-9,14-16,19,30H,3-7,10-13H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
ITPYQJRPDTUNPR-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