Compound Detail
CHEMBL599883
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
Basic Information
| ChEMBL ID | CHEMBL599883 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NAHCQBYVFUTQPQ-UHFFFAOYSA-N |
8
Targets
20
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
236.3
MW (Da)
0.45
ALogP
8
HBA
0
HBD
86.6
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 13 meas. best 6.82
IC50 7 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | EC50 | 6.82 | 6.692 | 150.0 | 5 |
| Plasmodium falciparum CHEMBL364 | IC50 | 6.82 | 6.76 | 150.0 | 2 |
| Trypanosoma brucei rhodesiense CHEMBL612348 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
| Trypanosoma brucei rhodesiense CHEMBL612348 | EC50 | 5.24 | 5.24 | 5700.0 | 2 |
| Leishmania donovani CHEMBL367 | IC50 | 5.1 | 5.1 | 8000.0 | 1 |
| Leishmania infantum CHEMBL612848 | EC50 | 5.07 | 5.07 | 8600.0 | 2 |
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
| Trypanosoma cruzi CHEMBL368 | EC50 | 4.8 | 4.8 | 16000.0 | 2 |
| HEK293 CHEMBL614818 | EC50 | 4.75 | 4.75 | 18000.0 | 1 |
| Trypanothione reductase CHEMBL5131 | IC50 | 4.57 | 4.57 | 27000.0 | 1 |
| L6 CHEMBL614793 | EC50 | 4.48 | 4.48 | 33000.0 | 1 |
| L6 CHEMBL614793 | IC50 | 4.48 | 4.48 | 33000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine