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Compound Detail

CHEMBL90039

BENZOPHENONE
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O=C(c1ccccc1)c1ccccc1

Basic Information

ChEMBL ID CHEMBL90039
Name BENZOPHENONE
Phase Preclinical
Structure Type MOL
InChI Key RWCCWEUUXYIKHB-UHFFFAOYSA-N
0
Targets
5
Activities
1
Assay Types
0
PK Parameters
18
Publications
0
Known Names

Molecular Properties

182.2
MW (Da)
2.92
ALogP
1
HBA
0
HBD
17.1
PSA (Ų)
0.65
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C13H10O
MW 182.22
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.31

Activity Summary

IC50 5 meas.

Literature References

PubMed DOI Target Context # Activities
6167716 10.1021/jm00135a006 ADMET 8
36966660 10.1016/j.bmc.2023.117255 Molecular identity unknown 6
27908763 10.1016/j.bmcl.2016.11.048 No relevant target 3
18995931 10.1016/j.ejmech.2008.09.018 Papain 3
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
15828829 10.1021/jm049011j Liver carboxylesterase 1 2
18995931 10.1016/j.ejmech.2008.09.018 Unchecked 2
19640715 10.1016/j.bmcl.2009.07.082 Unchecked 2
18995931 10.1016/j.ejmech.2008.09.018 Cathepsin B 1
30878192 10.1016/j.bmc.2019.03.017 No relevant target 1
22959206 10.1016/j.bmcl.2012.08.009 CCF-STTG1 1
20055453 10.1021/jm9014718 Indoleamine 2,3-dioxygenase 1 1
18995931 10.1016/j.ejmech.2008.09.018 Cathepsin G 1
16134935 10.1021/jm050403f Androgen receptor 1
15828829 10.1021/jm049011j Cholinesterase 1
15828829 10.1021/jm049011j Acetylcholinesterase 1
15828829 10.1021/jm049011j Cocaine esterase 1
6167716 10.1021/jm00135a006 No relevant target 1

Data from ChEMBL 36 via Core Engine