Compound Detail
CHEMBL6032207
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
CCC(O)(CC)Cn1nnc2cc(-c3ccc(CN4[C@@H]5CC[C@H]4[C@@H](N)C5)cc3-c3ccc(C#N)c(F)c3)c(F)c(Cl)c21
Basic Information
| ChEMBL ID | CHEMBL6032207 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NWJFRYSMQYQSHC-LARUCZGFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
591.1
MW (Da)
6.18
ALogP
7
HBA
2
HBD
104.0
PSA (Ų)
0.25
QED
2
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A CHEMBL6136 | IC50 | 10.12 | 10.12 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A | IC50 | = | 0.075 | nM | 10.12 | Inhibitory Activity (In Vitro): The conditions for measuring inhibitory activity... | - |
Data from ChEMBL 36 via Core Engine