Details of the Drug

General Information of Drug (ID: DM213MD)

Drug Name

M-Aminophenylboronic Acid

Synonyms

3-Aminophenylboronic acid; 30418-59-8; 3-Aminobenzeneboronic acid; (3-aminophenyl)boronic acid; M-AMINOPHENYLBORONIC ACID; 3-aminophenyl boronic acid; m-aminophenyl boronic acid; 3-amino phenylboronic acid; CHEMBL20852; Boronic acid, (3-aminophenyl)-; MFCD00007755; 280563-63-5; (m-Aminophenyl)metaboric acid; 3-Boronoaniline; EINECS 250-189-0; zlchem 430; 3-Aminophenylboronicacid; ACMC-1CTTO; 3amino phenylboronic acid; 3aminophenyl boronic acid; AC1L3NRS; (3-aminophenyl)boranediol; 3-amino-phenylboronic acid; AC1Q51DZ

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski):
0

Molecular Weight

136.95

Logarithm of the Partition Coefficient

Not Available

Rotatable Bond Count

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Chemical Identifiers

Formula: C6H8BNO2
IUPAC Name: (3-aminophenyl)boronic acid
Canonical SMILES: B(C1=CC(=CC=C1)N)(O)O
InChI: InChI=1S/C6H8BNO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4,9-10H,8H2
InChIKey: JMZFEHDNIAQMNB-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 92269
CAS Number: 30418-59-8
DrugBank ID: DB01896
TTD ID: D0E1XD

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Staphylococcus Beta-lactamase (Stap-coc blaZ)	TTHI19T	BLAC_STAAU	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.