Compound Detail
CHEMBL5840661
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Basic Information
| ChEMBL ID | CHEMBL5840661 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNEBTBGXNFSNKM-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
399.6
MW (Da)
5.19
ALogP
6
HBA
1
HBD
74.9
PSA (Ų)
0.48
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 15-hydroxyprostaglandin dehydrogenase [NAD(+)] CHEMBL1293255 | IC50 | 8.26 | 8.26 | 5.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 15-hydroxyprostaglandin dehydrogenase [NAD(+)] | IC50 | = | 5.55 | nM | 8.26 | In Vitro Assay: Each compound for inhibiting enzymatic activity of recombinant 1... | - |
| 15-hydroxyprostaglandin dehydrogenase [NAD(+)] | IC50 | = | 5.55 | nM | 8.26 | In Vitro Assay: Assays were done by measuring the transfer of tritium from 15(S)... | - |
Data from ChEMBL 36 via Core Engine