General Information of the Compound
Compound ID
CP0443532
Compound Name
4-benzamido-N-(3-chlorophenyl)benzamide
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Structure
Formula
C20H15ClN2O2
Molecular Weight
350.805
Canonical SMILES
Clc1cccc(NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c1
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InChI
InChI=1S/C20H15ClN2O2/c21-16-7-4-8-18(13-16)23-20(25)15-9-11-17(12-10-15)22-19(24)14-5-2-1-3-6-14/h1-13H,(H,22,24)(H,23,25)
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InChIKey
WNCNNFQOCUAMNA-UHFFFAOYSA-N
Physicochemical Property
logP
4.8446
Rotatable Bonds
4
Heavy Atom Count
25
Polar Areas
58.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
25

"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: 1217064
ChEMBL ID
CHEMBL2407267
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: PT06141, Major prion protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000900 ScN2a-cl3 Mus musculus (Mouse)  1
1
EC50 = 424 nM
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