Compound Detail
CHEMBL5922240
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
c1ccc(CCn2cc(-c3ccnc(Nc4ccc(N5CCNCC5)cc4)n3)c(-c3cccnc3)n2)cc1
Basic Information
| ChEMBL ID | CHEMBL5922240 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZYSLQYHMNQJKND-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
502.6
MW (Da)
4.80
ALogP
8
HBA
2
HBD
83.8
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Activin receptor type-1 CHEMBL5903 | IC50 | 7.73 | 7.395 | 18.7 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Activin receptor type-1 | IC50 | = | 18.7 | nM | 7.73 | Enzyme Inhibitory Assay: R206H: An overview of evaluation of an inhibitory effec... | - |
| Activin receptor type-1 | IC50 | = | 87.2 | nM | 7.06 | Enzyme Inhibitory Assay: TABLE 5: An overview of evaluation of an inhibitory eff... | - |
Data from ChEMBL 36 via Core Engine