General Information of the Compound
Compound ID
CP0382842
Compound Name
N-hydroxy-4-[(5-phenyltetrazol-2-yl)methyl]benzamide
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Structure
Formula
C15H13N5O2
Molecular Weight
295.302
Canonical SMILES
ONC(=O)c1ccc(Cn2nnc(n2)-c2ccccc2)cc1
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InChI
InChI=1S/C15H13N5O2/c21-15(18-22)13-8-6-11(7-9-13)10-20-17-14(16-19-20)12-4-2-1-3-5-12/h1-9,22H,10H2,(H,18,21)
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InChIKey
GASSJWYDVSUMDF-UHFFFAOYSA-N
Physicochemical Property
logP
1.5074
Rotatable Bonds
4
Heavy Atom Count
22
Polar Areas
92.93
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Complexity
22

"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: 135357401
ChEMBL ID
CHEMBL4456695
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: PT01213, Histone deacetylase 6
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 3 nM
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