Compound Detail
CHEMBL5759999
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
CCn1cc(-c2ccnc(Nc3cnn(C4CCN(CC(C)(C)O)CC4)c3)n2)c(-c2cccnc2)n1
Basic Information
| ChEMBL ID | CHEMBL5759999 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSNBDRSAUGKJEQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
487.6
MW (Da)
3.77
ALogP
10
HBA
2
HBD
109.8
PSA (Ų)
0.39
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.94
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Activin receptor type-1 CHEMBL5903 | IC50 | 7.94 | 7.94 | 11.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Activin receptor type-1 | IC50 | = | 11.5 | nM | 7.94 | Enzyme Inhibitory Assay: R206H: An overview of evaluation of an inhibitory effec... | - |
Data from ChEMBL 36 via Core Engine