General Information of the Compound
| Compound ID |
CP0531230
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-hydroxy-4-[[2-oxo-4-pyridin-3-yl-1-(pyridin-4-ylmethyl)quinolin-3-yl]oxymethyl]benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C28H22N4O4
|
||||||||||||||||||
| Molecular Weight |
478.508
|
||||||||||||||||||
| Canonical SMILES |
ONC(=O)c1ccc(COc2c(-c3cccnc3)c3ccccc3n(Cc3ccncc3)c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H22N4O4/c33-27(31-35)21-9-7-20(8-10-21)18-36-26-25(22-4-3-13-30-16-22)23-5-1-2-6-24(23)32(28(26)34)17-19-11-14-29-15-12-19/h1-16,35H,17-18H2,(H,31,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZIGUQGGMWRWVNK-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 | |||||||||||||||||||
| 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
Protein ID: PT00991, Histone deacetylase 1
Protein ID: PT01213, Histone deacetylase 6