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Compound Detail

CHEMBL22916

AMELTOLIDE
🧪 Phase II
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🧪 Phase II
Cc1cccc(C)c1NC(=O)c1ccc(N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL22916
Name AMELTOLIDE
Phase Phase II
Structure Type MOL
InChI Key HZIWGOAXOBPQGY-UHFFFAOYSA-N

Known Names

Ameltolida Ameltolide LY 201116 LY-201116
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
17
Publications
4
Known Names

Molecular Properties

240.3
MW (Da)
3.14
ALogP
2
HBA
2
HBD
55.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Year 1990

Extended Properties

Molecular Formula C15H16N2O
MW 240.31
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.13

Activity Summary

IC50 1 meas. best 6.01

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 6.01 6.01 970.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 970.0 nM 6.01 Apparent IC50 value by [3H]batrachotoxinin-A-20-alpha-benzoate-binding test perf... 9719582

Literature References

PubMed DOI Target Context # Activities
3656350 10.1021/jm00393a010 Mus musculus 13
4032429 10.1021/jm00147a024 Mus musculus 8
9719582 10.1021/jm9608772 Rattus norvegicus 6
9719582 10.1021/jm9608772 Mus musculus 4
2016702 10.1021/jm00108a003 Mus musculus 4
9719582 10.1021/jm9608772 ADMET 3
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
3735320 10.1021/jm00158a038 Mus musculus 2
2016702 10.1021/jm00108a003 Unchecked 1
3656350 10.1021/jm00393a010 Unchecked 1
4032429 10.1021/jm00147a024 ADMET 1
3735320 10.1021/jm00158a038 ADMET 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1
11170622 10.1021/jm000155h Rattus norvegicus 1
9719582 10.1021/jm9608772 Unchecked 1

Data from ChEMBL 36 via Core Engine