Compound Detail
CHEMBL107070
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Basic Information
| ChEMBL ID | CHEMBL107070 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FWHWVRTWACBFLP-KEBDBYFISA-N |
3
Targets
5
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
340.8
MW (Da)
3.67
ALogP
4
HBA
3
HBD
81.9
PSA (Ų)
0.50
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.57
Kd 1 meas. best 6.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glucagon receptor CHEMBL4720 | IC50 | 7.57 | 7.57 | 27.0 | 1 |
| ADMET CHEMBL612558 | Kd | 6.99 | 6.99 | 102.3 | 1 |
| Glucagon receptor CHEMBL1985 | IC50 | 6.7 | 6.6967 | 200.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glucagon receptor | IC50 | = | 27.0 | nM | 7.57 | Binding affinity towards rat Glucagon Receptor | 11543683 |
| ADMET | Kd | = | 102.33 | nM | 6.99 | pA2 value for the compound was calculated | 11543683 |
| Glucagon receptor | IC50 | = | 200.0 | nM | 6.7 | Binding affinity towards human Glucagon Receptor by the displacement of [125I]-g... | 11543683 |
| Glucagon receptor | IC50 | = | 200.0 | nM | 6.7 | In vitro inhibitory activity against human glucagon receptor using [127I]-labele... | 11844695 |
| Glucagon receptor | IC50 | = | 203.0 | nM | 6.69 | In vitro binding affinity for recombinant human glucagon receptor (hGGR) in BHK ... | 12477359 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11543683 | 10.1021/jm000547o | Glucagon receptor | 2 |
| 11543683 | 10.1021/jm000547o | ADMET | 1 |
| 11844695 | 10.1016/s0960-894x(01)00819-8 | Glucagon receptor | 1 |
| 12477359 | 10.1021/jm0208572 | Glucagon receptor | 1 |
Data from ChEMBL 36 via Core Engine