Compound Detail
CHEMBL1384702
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Basic Information
| ChEMBL ID | CHEMBL1384702 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKGNFJJJTAQTNP-UHFFFAOYSA-N |
9
Targets
13
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
400.3
MW (Da)
4.31
ALogP
5
HBA
0
HBD
73.6
PSA (Ų)
0.48
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 7 meas. best 7.08
IC50 6 meas. best 5.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein RecA CHEMBL1741171 | EC50 | 7.08 | 7.08 | 82.5 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.7 | 5.7 | 1993.0 | 1 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.65 | 5.65 | 2259.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.62 | 5.4167 | 2390.0 | 3 |
| Unchecked CHEMBL612545 | EC50 | 5.59 | 5.57 | 2553.0 | 2 |
| Heat shock factor protein 1 CHEMBL5313 | EC50 | 5.57 | 5.57 | 2675.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.31 | 5.31 | 4925.0 | 1 |
| Apoptotic protease-activating factor 1 CHEMBL1795093 | IC50 | 5.28 | 5.28 | 5290.0 | 1 |
| DNA damage-inducible transcript 3 protein CHEMBL2146304 | IC50 | 5.02 | 5.02 | 9460.0 | 1 |
| Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase CHEMBL1741212 | IC50 | 4.57 | 4.57 | 27100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine