General Information of the Compound
Compound ID
CP0317842
Compound Name
2-(pyrazin-2-yl)-1H-benzo[d]imidazole
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Structure
Formula
C11H8N4
Molecular Weight
196.213
Canonical SMILES
c1ccc2[nH]c(nc2c1)-c1cnccn1
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InChI
InChI=1S/C11H8N4/c1-2-4-9-8(3-1)14-11(15-9)10-7-12-5-6-13-10/h1-7H,(H,14,15)
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InChIKey
RUDHSKFULPGCLM-UHFFFAOYSA-N
Physicochemical Property
logP
2.0199
Rotatable Bonds
1
Heavy Atom Count
15
Polar Areas
54.46
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
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: 352929
SID: 16754711
ChEMBL ID
CHEMBL200059
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: PT00973, Methionine aminopeptidase 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 32900 nM
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