General Information of the Compound
Compound ID
CP0129520
Compound Name
3-Chloro-4-hydroxy-benzoic acid (4-hydroxy-naphthalen-1-ylmethylene)-hydrazide
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Structure
Formula
C18H13ClN2O3
Molecular Weight
340.766
Canonical SMILES
Oc1ccc(cc1Cl)C(=O)N\N=C\c1ccc(O)c2ccccc12
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InChI
InChI=1S/C18H13ClN2O3/c19-15-9-11(5-8-17(15)23)18(24)21-20-10-12-6-7-16(22)14-4-2-1-3-13(12)14/h1-10,22-23H,(H,21,24)/b20-10+
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InChIKey
FWHWVRTWACBFLP-KEBDBYFISA-N
Physicochemical Property
logP
3.6683
Rotatable Bonds
3
Heavy Atom Count
24
Polar Areas
81.92
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Complexity
24

"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: 135503676
SID: 15075618
ChEMBL ID
CHEMBL107070
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: PT01473, Glucagon receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000051 BHK-21 Mesocricetus auratus (Golden hamster)  1
1
IC50 = 203 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 200 nM