Compound Detail
CHEMBL1968355
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Basic Information
| ChEMBL ID | CHEMBL1968355 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AVDSFLMZEWGWOV-FMIVXFBMSA-N |
6
Targets
9
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
257.8
MW (Da)
3.10
ALogP
5
HBA
0
HBD
38.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 5 meas. best 6.43
IC50 4 meas. best 5.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.43 | 5.1 | 371.0 | 3 |
| Apoptotic protease-activating factor 1 CHEMBL1795093 | IC50 | 5.54 | 5.54 | 2900.0 | 1 |
| Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 CHEMBL2097170 | IC50 | 4.97 | 4.97 | 10600.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.64 | 4.64 | 22800.0 | 1 |
| Mannose-6-phosphate isomerase CHEMBL2758 | IC50 | 4.54 | 4.54 | 28848.0 | 1 |
| Hexokinase-1 CHEMBL2688 | EC50 | 4.4 | 4.4 | 39900.0 | 1 |
| Hexokinase HKDC1 CHEMBL1741200 | EC50 | 4.37 | 4.37 | 43100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine