General Information of the Compound
| Compound ID |
CP0514804
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-hydroxy-4-[[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]-5-oxophenothiazin-10-yl]methyl]benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C22H19N3O4S
|
||||||||||||||||||
| Molecular Weight |
421.478
|
||||||||||||||||||
| Canonical SMILES |
C\C(=N/O)c1ccc2[S+]([O-])c3ccccc3N(Cc3ccc(cc3)C(=O)NO)c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H19N3O4S/c1-14(23-27)17-10-11-21-19(12-17)25(18-4-2-3-5-20(18)30(21)29)13-15-6-8-16(9-7-15)22(26)24-28/h2-12,27-28H,13H2,1H3,(H,24,26)/b23-14+
Show/Hide
|
||||||||||||||||||
| InChIKey |
CCKKWDXFXMBWJL-OEAKJJBVSA-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: PT00994, Histone deacetylase 4
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01807, Histone deacetylase 7
Protein ID: PT01946, Histone deacetylase 9