General Information of the Compound
Compound ID
CP0862692
Compound Name
1-(tert-Butyl)-2-(perchlorocyclopenta-2,4-dien-1-ylidene)hydrazine
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Structure
Formula
C9H10Cl4N2
Molecular Weight
288.005
Canonical SMILES
CC(C)(C)NN=C1C(Cl)=C(Cl)C(Cl)=C1Cl
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InChI
InChI=1S/C9H10Cl4N2/c1-9(2,3)15-14-8-6(12)4(10)5(11)7(8)13/h15H,1-3H3
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InChIKey
SPAYNHKSYSEQSJ-UHFFFAOYSA-N
Physicochemical Property
logP
4.1225
Rotatable Bonds
1
Heavy Atom Count
15
Polar Areas
24.39
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
15

"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: 137653204
ChEMBL ID
CHEMBL4092413
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 > 5000 nM
   TI
   LI
   LO
   TS