Compound Detail
CHEMBL4633201
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CNC(=O)[C@H](CC1CCN(C(=O)c2cc(C(C)(C)C)nn2C)CC1)NC(=O)[C@H]1CCCC(=O)N1
Basic Information
| ChEMBL ID | CHEMBL4633201 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SLKUTPSFHQUWLD-SJORKVTESA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
1
Publications
0
Known Names
Molecular Properties
474.6
MW (Da)
0.86
ALogP
6
HBA
3
HBD
125.4
PSA (Ų)
0.56
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-alpha-acetyltransferase 50 CHEMBL4630854 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| t1/2 | - | - | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-alpha-acetyltransferase 50 | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of wild type human Naa50 (1852 to 2082 residues) expressed in Escheri... | 32550998 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32550998 | 10.1021/acsmedchemlett.0c00029 | N-alpha-acetyltransferase 50 | 5 |
Data from ChEMBL 36 via Core Engine