Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL290743

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CC12C(=O)NC(=O)N1CCc1ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL290743
Phase Preclinical
Structure Type MOL
InChI Key GGHIWSLHQDFHGG-UHFFFAOYSA-N
0
Targets
4
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

216.2
MW (Da)
1.01
ALogP
2
HBA
1
HBD
49.4
PSA (Ų)
0.66
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12N2O2
MW 216.24
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.08

Activity Summary

IC50 4 meas.

Literature References

PubMed DOI Target Context # Activities
9046351 10.1021/jm960692v Sodium channel alpha subunits; brain (Types I, II, III) 2
19346132 10.1016/j.bmc.2008.10.031 Unchecked 2
10229624 10.1021/jm980556l No relevant target 1
10229624 10.1021/jm980556l Sodium channel alpha subunits; brain (Types I, II, III) 1
9046351 10.1021/jm960692v No relevant target 1
19346132 10.1016/j.bmc.2008.10.031 No relevant target 1
24332655 10.1016/j.bmc.2013.11.049 Unchecked 1

Data from ChEMBL 36 via Core Engine