Compound Detail
CHEMBL1300836
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Basic Information
| ChEMBL ID | CHEMBL1300836 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YWAYDKKWJDMLAH-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1616197 |
| Active Moiety | CHEMBL1616197 |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
240.3
MW (Da)
2.72
ALogP
4
HBA
2
HBD
57.8
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 5.44 | 5.37 | 3600.0 | 2 |
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 5.01 | 5.01 | 9701.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 3600.0 | nM | 5.44 | PUBCHEM_BIOASSAY: Dose response confirmation of small molecule activators of the... | - |
| Unchecked | EC50 | = | 5026.0 | nM | 5.3 | PUBCHEM_BIOASSAY: Luminescent Cell-Based Dose Titration Retest Counterscreen to ... | - |
| Zinc finger protein mex-5 | EC50 | = | 9701.0 | nM | 5.01 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
Data from ChEMBL 36 via Core Engine