Compound Detail
CHEMBL1320230
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Basic Information
| ChEMBL ID | CHEMBL1320230 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RQEWMXYMYOWHQB-OXTPFRESSA-N |
9
Targets
10
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
372.4
MW (Da)
3.09
ALogP
6
HBA
2
HBD
82.8
PSA (Ų)
0.63
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 10 meas. best 5.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.73 | 5.67 | 1851.0 | 2 |
| Induced myeloid leukemia cell differentiation protein Mcl-1 CHEMBL4361 | IC50 | 5.62 | 5.62 | 2419.4 | 1 |
| Intestinal-type alkaline phosphatase CHEMBL3151 | IC50 | 4.8 | 4.8 | 15800.0 | 1 |
| Alkaline phosphatase, tissue-nonspecific isozyme CHEMBL5979 | IC50 | 4.59 | 4.59 | 25900.0 | 1 |
| Alkaline phosphatase, germ cell type CHEMBL3402 | IC50 | 4.57 | 4.57 | 27200.0 | 1 |
| Intestinal-type alkaline phosphatase CHEMBL5573 | IC50 | 4.51 | 4.51 | 30700.0 | 1 |
| Calpain-2 catalytic subunit CHEMBL4143 | IC50 | 4.32 | 4.32 | 47561.2 | 1 |
| Aminopeptidase N CHEMBL4117 | IC50 | 4.13 | 4.13 | 73520.0 | 1 |
| Bifunctional protein GlmU CHEMBL1293297 | IC50 | 4.09 | 4.09 | 80620.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine