General Information of the Compound
Compound ID |
CP0537530
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
3-tert-butyl-N-[4-(hydroxycarbamoyl)phenyl]benzamide
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C18H20N2O3
|
||||||||||||||||||
Molecular Weight |
312.369
|
||||||||||||||||||
Canonical SMILES |
CC(C)(C)c1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)NO
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C18H20N2O3/c1-18(2,3)14-6-4-5-13(11-14)16(21)19-15-9-7-12(8-10-15)17(22)20-23/h4-11,23H,1-3H3,(H,19,21)(H,20,22)
Show/Hide
|
||||||||||||||||||
InChIKey |
JPPULHHJZRLITK-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
Protein ID: PT02410, Histone deacetylase 11
Protein ID: PT00995, Histone deacetylase 3
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01499, Histone deacetylase 8