2-Aminoacetophenone
AlkaPlorer ID: AK020541
Synonym: 2-Amino-1-phenylethanone, Phenacylamine, Phenomydrol, Benzoylmethylamine, (Aminoacetyl)benzene
IUPAC Name: 2-amino-1-phenylethanone
Structure
SMILES: NCC(=O)C1=CC=CC=C1
InChI: InChI=1S/C8H9NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6,9H2
InChIKey: HEQOJEGTZCTHCF-UHFFFAOYSA-N
Reference
�ber den Geruchsstoff von Pseudomonas aeruginosa
PubChem CID: 11952
CAS: 103-84-4
LOTUS: LTS0085631
SuperNatural Ⅲ: SN0123503
NPASS: NPC107387
COCONUT: CNP0357301
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Vitis sp. | Vitis | Vitaceae | Vitales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 135.16599999999997
TPSA？: 43.09
MolLogP？: 0.828
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | DNA polymerase iota | Potency | 89125.1 | nM | None |
| Homo sapiens | Lysine-specific histone demethylase 1 | Inhibition | 30.0 | % | 10.1016/j.ejmech.2014.08.068 |
| Homo sapiens | Tyrosyl-DNA phosphodiesterase 1 | Potency | 10000.0 | nM | None |
| Rattus norvegicus | Serotonin (5-HT) receptor | pA2 | nan | None | 10.1021/jm00346a012 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 19952.62 | nM | 10.6019/CHEMBL4651402 |
| Severe acute respiratory syndrome coronavirus 2 | SARS-CoV-2 | IC50 | 20000.0 | nM | 10.6019/CHEMBL4651402 |