Compound Detail
CHEMBL1589425
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Basic Information
| ChEMBL ID | CHEMBL1589425 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DXLHUHJKEMQMBH-PNNXLEGYSA-M |
| Parent Compound | CHEMBL1625287 |
| Active Moiety | CHEMBL1625287 |
9
Targets
20
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
457.1
MW (Da)
8.84
ALogP
1
HBA
0
HBD
0.0
PSA (Ų)
0.19
QED
1
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 13 meas. best 5.42
EC50 7 meas. best 5.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.78 | 5.74 | 1670.0 | 2 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.76 | 5.76 | 1746.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.64 | 5.41 | 2314.0 | 2 |
| Ubiquitin-conjugating enzyme E2 N CHEMBL6089 | IC50 | 5.42 | 5.38 | 3770.0 | 2 |
| Streptococcus CHEMBL612313 | EC50 | 5.25 | 5.25 | 5624.0 | 1 |
| Protein RecA CHEMBL1741171 | EC50 | 5.24 | 5.24 | 5800.0 | 1 |
| Bcl-2-related protein A1 CHEMBL1293239 | IC50 | 5.09 | 5.09 | 8080.0 | 1 |
| Apoptotic protease-activating factor 1 CHEMBL1795093 | IC50 | 4.97 | 4.97 | 10600.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.88 | 4.7288 | 13220.0 | 8 |
| Melanocortin receptor 4 CHEMBL259 | IC50 | 4.51 | 4.51 | 31201.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine