General Information of the Compound
Compound ID
CP0007433
Compound Name
4-Amino-N-hydroxy-benzamide
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Structure
Formula
C7H8N2O2
Molecular Weight
152.153
Canonical SMILES
Nc1ccc(cc1)C(=O)NO
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InChI
InChI=1S/C7H8N2O2/c8-6-3-1-5(2-4-6)7(10)9-11/h1-4,11H,8H2,(H,9,10)
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InChIKey
DKGYBSPSUUVQRL-UHFFFAOYSA-N
CAS
26071-05-6
Physicochemical Property
logP
0.3878
Rotatable Bonds
1
Heavy Atom Count
11
Polar Areas
75.35
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Complexity
11

"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).

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PubChem ID
CID: 245297
SID: 15315437
ChEMBL ID
CHEMBL155579
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
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 7138 nM
   TI
   LI
   LO
   TS
Protein ID: PT01213, Histone deacetylase 6
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 389 nM
   TI
   LI
   LO
   TS
2
IC50 = 1395 nM
   TI
   LI
   LO
   TS