Details of the Drug

General Information of Drug (ID: DM75U9X)

Drug Name

Benzimidazole 5-carboxamide

Synonyms

116568-17-3; 1H-Benzo[d]imidazole-6-carboxamide; 1H-benzimidazole-5-carboxamide; 1H-Benzoimidazole-5-carboxylic acid amide; 1H-Benzimidazole-6-carboxamide; 1H-Benzo[d]imidazole-5-carboxamide; 1H-1,3-benzodiazole-5-carboxamide; benzimidazole-5-carboxamide; FNLQDVXHDNFXIY-UHFFFAOYSA-N; ACMC-20mmnb; benzoimidazole-5-carboxamide; SCHEMBL476587; 1H-Benzoimidazole-5-carboxamide; CTK8E3251; CTK0H3052; DTXSID30572624; MolPort-000-353-183; BCP27970; 2711AA; ZINC27986912; STL200279; AKOS002314950; AKOS022171450; FS-2220; MCULE-9328613043

Indication

Disease Entry	ICD 11	Status	REF
Hepatovirus infection	1E51	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

161.16

Logarithm of the Partition Coefficient (xlogp)

0.7

Rotatable Bond Count (rotbonds)

1

Hydrogen Bond Donor Count (hbonddonor)

2

Hydrogen Bond Acceptor Count (hbondacc)

2

Chemical Identifiers

Formula: C8H7N3O
IUPAC Name: 3H-benzimidazole-5-carboxamide
Canonical SMILES: C1=CC2=C(C=C1C(=O)N)NC=N2
InChI: InChI=1S/C8H7N3O/c9-8(12)5-1-2-6-7(3-5)11-4-10-6/h1-4H,(H2,9,12)(H,10,11)
InChIKey: FNLQDVXHDNFXIY-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 15421642
CAS Number: 116568-17-3
TTD ID: D0D4QL

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Human immunodeficiency virus Reverse transcriptase (HIV RT)	TT84ETX	POL_HV1B1	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Emerging antiviral drugs. Expert Opin Emerg Drugs. 2008 Sep;13(3):393-416.