General Information of the Compound
| Compound ID |
CP0940712
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(4-(4-(4-methoxyphenyl)piperazin-1-yl)butyl)pyrimido[5,4-c]quinolin-4(3H)-one hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H30ClN5O2
|
||||||||||||||||||
| Molecular Weight |
480.012
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(N2CCN(CCCCn3cnc4c(cnc5ccccc54)c3=O)CC2)cc1.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H29N5O2.ClH/c1-33-21-10-8-20(9-11-21)30-16-14-29(15-17-30)12-4-5-13-31-19-28-25-22-6-2-3-7-24(22)27-18-23(25)26(31)32;/h2-3,6-11,18-19H,4-5,12-17H2,1H3;1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
GRVNSVJFWZNMDS-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