4-(2-Amino-1-hydroxyethyl)-2-fluorophenol

Details

Top
Internal ID f9f83f29-8c20-42ba-8e8a-7753b609b30a
Taxonomy Benzenoids > Phenols > Halophenols > Fluorophenols > O-fluorophenols
IUPAC Name 4-(2-amino-1-hydroxyethyl)-2-fluorophenol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C8H10FNO2/c9-6-3-5(8(12)4-10)1-2-7(6)11/h1-3,8,11-12H,4,10H2
InChI Key TYFNBAWXKVCFMT-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

Top
Molecular Formula C8H10FNO2
Molecular Weight 171.17 g/mol
Exact Mass 171.06955672 g/mol
Topological Polar Surface Area (TPSA) 66.50 Ų
XlogP -0.80

Synonyms

Top
CHEMBL1191220

2D Structure

Top
2D Structure of 4-(2-Amino-1-hydroxyethyl)-2-fluorophenol

3D Structure

Top

ADMET Properties (via admetSAR 2)

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

Targets

Top

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 98.35% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 95.38% 96.09%
CHEMBL1860 P10827 Thyroid hormone receptor alpha 94.54% 99.15%
CHEMBL3492 P49721 Proteasome Macropain subunit 94.09% 90.24%
CHEMBL4581 P52732 Kinesin-like protein 1 91.63% 93.18%
CHEMBL3038469 P24941 CDK2/Cyclin A 88.37% 91.38%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 85.93% 97.23%
CHEMBL2335 P42785 Lysosomal Pro-X carboxypeptidase 85.25% 100.00%
CHEMBL4208 P20618 Proteasome component C5 85.13% 90.00%
CHEMBL3401 O75469 Pregnane X receptor 82.48% 94.73%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 82.11% 94.45%
CHEMBL3902 P09211 Glutathione S-transferase Pi 81.71% 93.81%
CHEMBL225 P28335 Serotonin 2c (5-HT2c) receptor 81.44% 89.62%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.43% 99.17%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 80.11% 95.56%

Plants that contains it

Top
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.
There are no matching plants.

Cross-Links

Top
PubChem 37722
LOTUS LTS0044790
wikiData Q105267289