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Compound Detail

CHEMBL127123

PHENACAINE
🧪 Phase II
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🧪 Phase II
CCOc1ccc(/N=C(\C)Nc2ccc(OCC)cc2)cc1

Basic Information

ChEMBL ID CHEMBL127123
Name PHENACAINE
Phase Phase II
Structure Type MOL
InChI Key QXDAEKSDNVPFJG-UHFFFAOYSA-N

Known Names

Fenacaina Phenacaine
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
2
Known Names

Molecular Properties

298.4
MW (Da)
4.65
ALogP
3
HBA
1
HBD
42.9
PSA (Ų)
0.62
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Stem -caine

Extended Properties

Molecular Formula C18H22N2O2
MW 298.39
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.86

Activity Summary

IC50 1 meas. best 5.77

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Sodium channel alpha subunits; brain (Types I, II, III)
CHEMBL2096682
IC50 5.77 5.77 1700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
2579237 10.1021/jm00381a019 Sodium channel alpha subunits; brain (Types I, II, III) 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
24332655 10.1016/j.bmc.2013.11.049 Unchecked 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1

Data from ChEMBL 36 via Core Engine