Compound Detail
CHEMBL1387605
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Basic Information
| ChEMBL ID | CHEMBL1387605 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IKCQYPIFZFLJAS-UHFFFAOYSA-N |
6
Targets
13
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
305.4
MW (Da)
4.13
ALogP
5
HBA
1
HBD
58.9
PSA (Ų)
0.60
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 11 meas. best 6.67
IC50 2 meas. best 6.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.67 | 5.6625 | 216.0 | 4 |
| Streptokinase A CHEMBL1293228 | EC50 | 6.58 | 6.58 | 261.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.41 | 6.41 | 391.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 6.24 | 6.24 | 571.0 | 1 |
| Kappa-type opioid receptor CHEMBL237 | IC50 | 5.75 | 5.75 | 1790.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 4.88 | 4.88 | 13204.0 | 1 |
| BJ CHEMBL614358 | EC50 | 4.81 | 4.7833 | 15616.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine