Compound Detail
CHEMBL3961121
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Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc3c(c2)CCN(C(=O)NCc2ccccc2)CC3)cc1
Basic Information
| ChEMBL ID | CHEMBL3961121 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BKXDRHXLHBXMRX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
492.6
MW (Da)
3.82
ALogP
4
HBA
3
HBD
107.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Voltage-gated potassium channel subfamily A member 1/beta-1 CHEMBL3988636 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Voltage-gated potassium channel subfamily A member 1/beta-1 | IC50 | = | 50000.0 | nM | 4.3 | Inhibition of His/FLAG-tagged Kv1.1alpha T1 domain (unknown origin) interaction ... | - |
Data from ChEMBL 36 via Core Engine