General Information of the Compound
Compound ID
CP0211151
Compound Name
2-(2-pyridinyl)-3H-benzimidazol-5-amine
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Synonyms
1H-Benzimidazol-5-amine, 2-(2-pyridinyl)-
1H-Benzimidazol-6-amine, 2-(2-pyridinyl)-
2-(Pyridin-2-yl)-1H-1,3-benzodiazol-6-amine
2-(pyridin-2-yl)-1H-1,3-benzodiazol-5-amine
2-(pyridin-2-yl)-1H-benzo[d]imidazol-5-amine
2-Pyridin-2-yl-1H-benzoimidazol-5-ylamine
2-pyridin-2-yl-3H-benzimidazol-5-amine
55396-63-9
AC1LBVAV
AC1Q52EP
BDBM62926
CHEMBL199925
CTK1F6864
DTXSID50337459
ITFXYBZUPPBWEC-UHFFFAOYSA-N
MLS000528495
MolPort-001-815-306
MolPort-006-709-925
SCHEMBL4371835
SCHEMBL8556415
SMR000121070
cid_542828
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Structure
Formula
C12H10N4
Molecular Weight
210.24
Canonical SMILES
Nc1ccc2nc([nH]c2c1)-c1ccccn1
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InChI
InChI=1S/C12H10N4/c13-8-4-5-9-11(7-8)16-12(15-9)10-3-1-2-6-14-10/h1-7H,13H2,(H,15,16)
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InChIKey
ITFXYBZUPPBWEC-UHFFFAOYSA-N
Physicochemical Property
logP
2.2071
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
67.59
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
16

"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: 542828
SID: 15067925
ChEMBL ID
CHEMBL199925
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 = 9300 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( 2-(pyridin-2-yl)-1H-benzo[d]imidazol-5-amine )
Drug Name 2-(pyridin-2-yl)-1H-benzo[d]imidazol-5-amine
Target(s)
Methionine aminopeptidase 2 (METAP2)
Inhibitor