Compound Detail
CHEMBL286013
DIMEBUTIC ACID 🧪 Phase II
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL286013 |
| Name | DIMEBUTIC ACID |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | VUAXHMVRKOTJKP-UHFFFAOYSA-N |
2
Targets
23
Activities
2
Assay Types
30
PK Parameters
20
Publications
6
Known Names
Molecular Properties
116.2
MW (Da)
1.51
ALogP
1
HBA
1
HBD
37.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
EC50 21 meas. best 6.1
IC50 2 meas.
Target Activity Profile
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 70155.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 37512.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 218723.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 1245621.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 9672.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 5520.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 33051.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 243656.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 91300.0 | ng.hr.mL-1 | Sus scrofa domesticus |
| AUC | 212000.0 | ng.hr.mL-1 | Sus scrofa domesticus |
| AUC | 619000.0 | ng.hr.mL-1 | Sus scrofa domesticus |
| AUC | 1750000.0 | ng.hr.mL-1 | Sus scrofa domesticus |
| AUC | 4290000.0 | ng.hr.mL-1 | Sus scrofa domesticus |
| CL | 7.28 | mL.min-1.kg-1 | Mus musculus |
| CL | 17.3 | mL.min-1.kg-1 | Rattus norvegicus |
| Cmax | 511621.9 | nM | Mus musculus |
| Cmax | 290375.34 | nM | Mus musculus |
| Cmax | 1017992.42 | nM | Mus musculus |
| Cmax | 4000946.97 | nM | Mus musculus |
| Cmax | 36733.82 | nM | Rattus norvegicus |
| Cmax | 188791.32 | nM | Rattus norvegicus |
| Cmax | 969094.35 | nM | Rattus norvegicus |
| Cmax | 138601.93 | nM | Sus scrofa domesticus |
| Cmax | 186811.29 | nM | Sus scrofa domesticus |
| Cmax | 550103.31 | nM | Sus scrofa domesticus |
| Cmax | 1231060.61 | nM | Sus scrofa domesticus |
| Cmax | 3236914.6 | nM | Sus scrofa domesticus |
| F | 53.4 | % | Mus musculus |
| F | 93.3 | % | Mus musculus |
| F | 177.5 | % | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine