General Information of the Compound
Compound ID
CP0904881
Compound Name
1-(Perchlorocyclopenta-2,4-dien-1-ylidene)-2-phenylhydrazine
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Structure
Formula
C11H6Cl4N2
Molecular Weight
307.995
Canonical SMILES
ClC1=C(Cl)C(Cl)=C(Cl)C1=NNc1ccccc1
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InChI
InChI=1S/C11H6Cl4N2/c12-7-8(13)10(15)11(9(7)14)17-16-6-4-2-1-3-5-6/h1-5,16H
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InChIKey
LFEQORQRZLZBJS-UHFFFAOYSA-N
Physicochemical Property
logP
4.8465
Rotatable Bonds
2
Heavy Atom Count
17
Polar Areas
24.39
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
17

"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: 137636051
ChEMBL ID
CHEMBL4064715
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: PT06430, DEP domain-containing mTOR-interacting protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000186 RPMI-8226 Homo sapiens (Human)  1
1
IC50 = 700 nM
   TI
   LI
   LO
   TS
Cell Viability or Cytotoxicity Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000186 RPMI-8226 Homo sapiens (Human)  1
1
IC50 = 600 nM
   TI
   LI
   LO
   TS