Compound Detail
CHEMBL11610
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Basic Information
| ChEMBL ID | CHEMBL11610 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UKWNRXJJWQXNTC-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
481.5
MW (Da)
1.57
ALogP
9
HBA
5
HBD
197.7
PSA (Ų)
0.28
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.59
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| L1210 CHEMBL386 | IC50 | 9.59 | 9.59 | 0.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| L1210 | IC50 | = | 0.26 | nM | 9.59 | Compound was evaluated for inhibitory effect on growth of L1210 cells at IC50 (n... | 2423690 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2423690 | 10.1021/jm00156a029 | L1210 | 4 |
| 2423690 | 10.1021/jm00156a029 | Dihydrofolate reductase | 1 |
Data from ChEMBL 36 via Core Engine