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name Structure Reference Source Properties Activities Metabolism

2-Phenyl-4-oxohydroquinoline

AlkaPlorer ID: AK006869

Synonym: None

IUPAC Name: 2-phenyl-1H-quinolin-4-one

Structure

SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3N2

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InChI: InChI=1S/C15H11NO/c17-15-10-14(11-6-2-1-3-7-11)16-13-9-5-4-8-12(13)15/h1-10H,(H,16,17)

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InChIKey: JGABMVVOXLQCKZ-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Aspergillus flavus Aspergillus Aspergillaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 221.259

TPSA？: 32.86

MolLogP？: 3.195100000000001

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Escherichia coli K-12 Beta-lactamase AmpC Potency 63095.7 nM None
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 12589.3 nM None
Homo sapiens 15-hydroxyprostaglandin dehydrogenase [NAD+] Potency 31622.8 nM None
Homo sapiens A549 EC50 0.5 ug.mL-1 10.1021/jm00061a005
Homo sapiens Ataxin-2 Potency 19952.6 nM None
Homo sapiens ATPase family AAA domain-containing protein 5 Potency 1158.2 nM None
Homo sapiens Cathepsin L IC50 2600.0 nM 10.1016/j.ejmech.2012.04.002
Homo sapiens Cathepsin L2 IC50 4700.0 nM 10.1016/j.ejmech.2012.04.002
Homo sapiens Cellular tumor antigen p53 Potency 25118.9 nM None
Homo sapiens Chromobox protein homolog 1 Potency 89125.1 nM None
Homo sapiens DNA dC->dU-editing enzyme APOBEC-3F Potency 1575.8 nM None
Homo sapiens DNA dC->dU-editing enzyme APOBEC-3F Potency 2225.8 nM None
Homo sapiens DNA dC->dU-editing enzyme APOBEC-3G Potency 1995.3 nM None
Homo sapiens DNA dC->dU-editing enzyme APOBEC-3G Potency 3144.1 nM None
Homo sapiens Endoplasmic reticulum-associated amyloid beta-peptide-binding protein Potency 15848.9 nM None
Homo sapiens Geminin Potency 1299.5 nM None
Homo sapiens Geminin Potency 2310.9 nM None
Homo sapiens Guanine nucleotide-binding protein G(s), subunit alpha Potency 891.3 nM None
Homo sapiens HCT-8 EC50 0.8 ug.mL-1 10.1021/jm00061a005
Homo sapiens HepG2-CD81 HEPG2TOX ASSAY - CC50 0.17 uM 10.1126/science.aat9446
Homo sapiens HepG2-CD81 HEPG2TOX ASSAY - CC90 0.17 uM 10.1126/science.aat9446
Homo sapiens Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Potency 44668.4 nM None
Homo sapiens Huh-7 CC50 93220.0 nM 10.1073/pnas.0802982105
Homo sapiens Isocitrate dehydrogenase [NADP] cytoplasmic Potency 2059.6 nM None
Homo sapiens KB EC50 0.09 ug.mL-1 10.1021/jm00061a005
Homo sapiens Lysine-specific demethylase 4D-like Potency 25118.9 nM None
Homo sapiens Neuropeptide S receptor Potency 25118.9 nM None
Homo sapiens Prelamin-A/C Potency 3162.3 nM None
Homo sapiens RPMI-7951 EC50 0.37 ug.mL-1 10.1021/jm00061a005
Homo sapiens Tubulin IC50 7300.0 nM 10.1021/jm00061a005
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 517.4 nM None
Homo sapiens Tyrosyl-DNA phosphodiesterase 1 Potency 920.0 nM None
Human immunodeficiency virus 1 Aberrant vpr protein Potency 31622.8 nM None
Influenza A virus Nonstructural protein 1 Potency 4466.8 nM None
Mus musculus Eukaryotic translation initiation factor 4E IC50 64000.0 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 7943.3 nM None
Mus musculus Nuclear receptor ROR-gamma Potency 35481.3 nM None
Mus musculus P388 EC50 0.08 ug.mL-1 10.1021/jm00061a005
Photinus pyralis Luciferin 4-monooxygenase Potency 26854.5 nM None
Plasmodium berghei Plasmodium berghei LUCIFERASE EXPRESSION CONTROL - IC50 14.9 uM 10.1126/science.aat9446
Plasmodium berghei Plasmodium berghei LUCIFERASE EXPRESSION CONTROL - IC90 14.9 uM 10.1126/science.aat9446
Plasmodium berghei Plasmodium berghei LUCIFERASE INFECTION ASSAY - IC50 0.17 uM 10.1126/science.aat9446
Plasmodium berghei Plasmodium berghei LUCIFERASE INFECTION ASSAY - IC90 0.307 uM 10.1126/science.aat9446
Plasmodium falciparum Plasmodium falciparum EC50 547.0 nM 10.1073/pnas.0802982105
Plasmodium falciparum Plasmodium falciparum EC50 1060.0 nM 10.1073/pnas.0802982105
Plasmodium falciparum Plasmodium falciparum Potency 1471.6 nM None
Plasmodium yoelii Plasmodium yoelii Activity nan None 10.1126/science.1211936
Rattus norvegicus Brain Activity 0.87 nmol 10.1016/j.bmc.2011.11.068
Rattus norvegicus Brain Activity 0.91 nmol 10.1016/j.bmc.2011.11.068
Rattus norvegicus Brain Activity nan None 10.1016/j.bmc.2011.11.068
Rattus norvegicus Rattus norvegicus Protection 17.0 % 10.1016/0960-894X(96)00134-5
Sus scrofa Tubulin alpha chain IC50 7300.0 nM 10.1021/jm0101085
None L1210 (1565) EC50 0.06 ug.mL-1 10.1021/jm00061a005
None NON-PROTEIN TARGET Activity nan None 10.1016/j.bmc.2011.11.068
None NON-PROTEIN TARGET Ratio 0.53 None 10.1016/j.bmc.2011.11.068
None NON-PROTEIN TARGET Ratio 1.06 None 10.1016/j.bmc.2011.11.068
None NON-PROTEIN TARGET Ratio 4.79 None 10.1016/j.bmc.2011.11.068
None No relevant target Activity nan None 10.1016/j.bmc.2011.11.068
None No relevant target LogD7.4 2.54 None 10.6019/CHEMBL3301361
None No relevant target Ratio 1.91 None 10.1016/j.bmc.2011.11.068
None No relevant target Solubility 100000.0 nM 10.1016/j.bmcl.2010.11.110
None Unchecked AbsAC26_uM 0.433 uM None
None Unchecked AbsAC35_uM 2.48 uM None
None Unchecked IC50 15500.0 nM None
None Unchecked IC50 80000.0 nM None
None Unchecked IFI 7.092 % 10.1073/pnas.0802982105
None Unchecked Kd 199526.23 nM 10.1016/j.bmcl.2010.11.110
None Unchecked Potency 730.5 nM None
None Unchecked Potency 794.3 nM None
None Unchecked Potency 1258.9 nM None
None Unchecked Potency 1995.3 nM None
None Unchecked Potency 2310.9 nM None
None Unchecked Potency 2818.4 nM None
None Unchecked Potency 11220.2 nM None
None Unchecked Potency 11582.1 nM None
None Unchecked Ratio IC50 0.6 None 10.1016/j.ejmech.2012.04.002

Metabolism Information