General Information of the Compound
Compound ID
CP0317844
Compound Name
5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazole
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Synonyms
1H-Benzimidazole, 6-fluoro-2-(2-pyridinyl)-
5-FLUORO-2-(2-PYRIDYL)-1H-BENZIMIDAZOLE
5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazole
5-fluoro-2-pyridin-2-yl-1H-benzoimidazole
6-fluoro-2-(pyridin-2-yl)-1H-1,3-benzodiazole
875468-81-8
AKOS010206775
BC4242268
BDBM50180735
CHEMBL199982
DTXSID90470258
KB-87704
MolPort-009-677-335
MolPort-027-941-496
NE40467
PC450144
SCHEMBL124265
TL80090069
US8748618, LD-1-31
ZINC13679485
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Structure
Formula
C12H8FN3
Molecular Weight
213.215
Canonical SMILES
Fc1ccc2nc([nH]c2c1)-c1ccccn1
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InChI
InChI=1S/C12H8FN3/c13-8-4-5-9-11(7-8)16-12(15-9)10-3-1-2-6-14-10/h1-7H,(H,15,16)
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InChIKey
AUSVDSQFCRIAEX-UHFFFAOYSA-N
Physicochemical Property
logP
2.764
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
41.57
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
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: 11665659
SID: 16769382
ChEMBL ID
CHEMBL199982
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 = 14900 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( 5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazole )
Drug Name 5-fluoro-2-(pyridin-2-yl)-1H-benzo[d]imidazole
Target(s)
Methionine aminopeptidase 2 (METAP2)
Inhibitor