Compound Detail
CHEMBL6002210
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Cc1ccc(-c2ccc(CN3[C@@H]4CC[C@H]3[C@@H](N)C4)cc2-c2ccc(C#N)c(F)c2)c(F)c1
Basic Information
| ChEMBL ID | CHEMBL6002210 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KPYWXDBMUKCOJZ-PHXCCWLDSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
429.5
MW (Da)
5.54
ALogP
3
HBA
1
HBD
53.0
PSA (Ų)
0.59
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A CHEMBL6136 | IC50 | 10.21 | 10.21 | 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 | = | 0.062 | nM | 10.21 | Inhibitory Activity (In Vitro): The conditions for measuring inhibitory activity... | - |
Data from ChEMBL 36 via Core Engine