Compound Detail
CHEMBL1544561
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Basic Information
| ChEMBL ID | CHEMBL1544561 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ANXKJACJVUEQOC-UHFFFAOYSA-N |
| Parent Compound | CHEMBL568092 |
| Active Moiety | CHEMBL568092 |
7
Targets
14
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
262.4
MW (Da)
4.89
ALogP
2
HBA
1
HBD
28.8
PSA (Ų)
0.55
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 9 meas. best 6.02
IC50 5 meas. best 6.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Jurkat CHEMBL397 | IC50 | 6.04 | 6.04 | 920.0 | 1 |
| BJ CHEMBL614358 | EC50 | 6.02 | 5.6025 | 949.0 | 4 |
| Galanin receptor type 3 CHEMBL2731 | IC50 | 5.89 | 5.89 | 1284.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.62 | 4.9467 | 2390.0 | 3 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.51 | 5.51 | 3088.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.39 | 5.075 | 4096.0 | 2 |
| Unchecked CHEMBL612545 | EC50 | 5.1 | 5.1 | 8008.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 4.99 | 4.99 | 10290.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine