N-Methylanthranilic acid

Details

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Internal ID bc746dee-ff0b-45db-b001-7b3293a1cc6e
Taxonomy Benzenoids > Benzene and substituted derivatives > Benzoic acids and derivatives > Aminobenzoic acids and derivatives > Aminobenzoic acids
IUPAC Name 2-(methylamino)benzoic acid
SMILES (Canonical) CNC1=CC=CC=C1C(=O)O
SMILES (Isomeric) CNC1=CC=CC=C1C(=O)O
InChI InChI=1S/C8H9NO2/c1-9-7-5-3-2-4-6(7)8(10)11/h2-5,9H,1H3,(H,10,11)
InChI Key WVMBPWMAQDVZCM-UHFFFAOYSA-N
Popularity 126 references in papers

Physical and Chemical Properties

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Molecular Formula C8H9NO2
Molecular Weight 151.16 g/mol
Exact Mass 151.063328530 g/mol
Topological Polar Surface Area (TPSA) 49.30 Ų
XlogP 2.00

Synonyms

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2-(Methylamino)benzoic acid
119-68-6
N-Methyl-2-aminobenzoic acid
Benzoic acid, 2-(methylamino)-
N-Methyl-o-aminobenzoic acid
o-(Methylamino)benzoic acid
Anthranilic acid, N-methyl-
Kyselina N-methylanthranilova
Kyselina 2-methylaminobenzoova
N-methyl-anthranilic acid
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of N-Methylanthranilic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL2581 P07339 Cathepsin D 92.86% 98.95%
CHEMBL1293294 P51151 Ras-related protein Rab-9A 90.78% 87.67%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 90.33% 96.09%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 88.32% 95.50%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.58% 95.56%
CHEMBL5847 P52895 Aldo-keto reductase family 1 member C2 85.72% 92.50%
CHEMBL221 P23219 Cyclooxygenase-1 83.70% 90.17%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 82.69% 81.11%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 82.65% 91.11%
CHEMBL5284 Q96RR4 CaM-kinase kinase beta 82.46% 89.23%
CHEMBL3807 P17706 T-cell protein-tyrosine phosphatase 80.81% 93.00%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 80.57% 94.62%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Ruta graveolens
Siphonochilus aethiopicus
Zanthoxylum integrifoliolum

Cross-Links

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PubChem 67069
LOTUS LTS0121854
wikiData Q27101885