Compound Detail
CHEMBL6048811
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Basic Information
| ChEMBL ID | CHEMBL6048811 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QBKPYKWJSWOHNY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
341.5
MW (Da)
2.54
ALogP
3
HBA
1
HBD
66.6
PSA (Ų)
0.92
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 5.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Poly [ADP-ribose] polymerase 2 CHEMBL5366 | Kd | 5.85 | 5.85 | 1400.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Poly [ADP-ribose] polymerase 2 | Kd | = | 1400.0 | nM | 5.85 | Biochemical Assay: Preferably, for the screening method above cited, both the PA... | - |
| Poly [ADP-ribose] polymerase 2 | Kd | = | 1400.0 | nM | 5.85 | Biochemical Assay: The assay is based on the use of a probe of formula (IP) that... | - |
Data from ChEMBL 36 via Core Engine