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

CHEMBL443266

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
COC1(c2ccccc2)CCCNC1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL443266
Phase Preclinical
Structure Type MOL
InChI Key FPBQWKKYPUOTJH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

205.3
MW (Da)
1.44
ALogP
2
HBA
1
HBD
38.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H15NO2
MW 205.26
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 0.35

Literature References

PubMed DOI Target Context # Activities
2846842 10.1021/jm00119a025 Mus musculus 6
6694169 10.1021/jm00368a017 Mus sp. 5
6694169 10.1021/jm00368a017 Mus musculus 4
2846842 10.1021/jm00119a025 Sodium channel alpha subunits; brain (Types I, II, III) 1

Data from ChEMBL 36 via Core Engine