2-[(2-Hydroxybenzoyl)amino]benzoic acid

Details

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Internal ID a9b26248-a9fb-4f5c-afc1-3844b284dbec
Taxonomy Benzenoids > Benzene and substituted derivatives > Anilides > Aromatic anilides > Benzanilides
IUPAC Name 2-[(2-hydroxybenzoyl)amino]benzoic acid
SMILES (Canonical) C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=CC=C2O
SMILES (Isomeric) C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC=CC=C2O
InChI InChI=1S/C14H11NO4/c16-12-8-4-2-6-10(12)13(17)15-11-7-3-1-5-9(11)14(18)19/h1-8,16H,(H,15,17)(H,18,19)
InChI Key CDKACLITEIDAIS-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C14H11NO4
Molecular Weight 257.24 g/mol
Exact Mass 257.06880783 g/mol
Topological Polar Surface Area (TPSA) 86.60 Ų
XlogP 3.30

Synonyms

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13316-98-8
Benzoic acid, 2-[(2-hydroxybenzoyl)amino]-
N-Salicyloylanthranilic acid
SCHEMBL4669122
SCHEMBL11405554
DTXSID20332638
AKOS000127375

2D Structure

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2D Structure of 2-[(2-Hydroxybenzoyl)amino]benzoic 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
CHEMBL1293294 P51151 Ras-related protein Rab-9A 97.45% 87.67%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 95.08% 81.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 92.35% 95.56%
CHEMBL2035 P08912 Muscarinic acetylcholine receptor M5 89.07% 94.62%
CHEMBL3714130 P46095 G-protein coupled receptor 6 88.97% 97.36%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 88.03% 99.23%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 87.33% 91.11%
CHEMBL221 P23219 Cyclooxygenase-1 86.22% 90.17%
CHEMBL2535 P11166 Glucose transporter 84.27% 98.75%
CHEMBL5847 P52895 Aldo-keto reductase family 1 member C2 84.18% 92.50%
CHEMBL4901 P54753 Ephrin type-B receptor 3 83.79% 87.50%
CHEMBL2321614 Q9NPC2 Potassium channel subfamily K member 9 83.77% 80.00%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 83.21% 95.50%
CHEMBL2096618 P11274 Bcr/Abl fusion protein 81.81% 85.83%
CHEMBL2581 P07339 Cathepsin D 80.13% 98.95%

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.
Dianthus caryophyllus

Cross-Links

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PubChem 459348
LOTUS LTS0197413
wikiData Q82097388