Compound Detail
CHEMBL1688967
IMMUNICILLIN H 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 | CHEMBL1688967 |
| Name | IMMUNICILLIN H |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DPRSKJHWKNHBOW-KCGFPETGSA-N |
5
Targets
5
Activities
2
Assay Types
0
PK Parameters
14
Publications
0
Known Names
Molecular Properties
267.2
MW (Da)
-1.66
ALogP
7
HBA
4
HBD
120.6
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 5.38
IC50 2 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human betaherpesvirus 5 CHEMBL371 | IC50 | 5.46 | 5.46 | 3500.0 | 1 |
| Trypanosoma brucei brucei CHEMBL612851 | EC50 | 5.38 | 5.38 | 4200.0 | 1 |
| HFF CHEMBL614071 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
| Trypanosoma brucei rhodesiense CHEMBL612348 | EC50 | 4.72 | 4.72 | 19100.0 | 1 |
| MRC5 CHEMBL614181 | EC50 | 4.5 | 4.5 | 31300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human betaherpesvirus 5 | IC50 | = | 3500.0 | nM | 5.46 | Inhibitory concentration against human cytomegalovirus (HCMV) in plaque reductio... | 2846837 |
| Trypanosoma brucei brucei | EC50 | = | 4200.0 | nM | 5.38 | Antitrypanosomal activity against Trypanosoma brucei brucei assessed as reductio... | 31931339 |
| HFF | IC50 | = | 10000.0 | nM | 5.0 | Cytotoxicity against uninfected human foreskin fibroblast(HFF cells) | 2846837 |
| Trypanosoma brucei rhodesiense | EC50 | = | 19100.0 | nM | 4.72 | Antitrypanosomal activity against Trypanosoma brucei rhodesiense assessed as red... | 31931339 |
| MRC5 | EC50 | = | 31300.0 | nM | 4.5 | Cytotoxicity against human MRC5 cells assessed as reduction in cell viability in... | 31931339 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20921305 | 10.1128/aac.01029-10 | Bacillus anthracis | 2 |
| 31931339 | 10.1016/j.ejmech.2019.112018 | Unchecked | 2 |
| 2846837 | 10.1021/jm00119a006 | Human betaherpesvirus 5 | 1 |
| 2846837 | 10.1021/jm00119a006 | HFF | 1 |
| 2846837 | 10.1021/jm00119a006 | ADMET | 1 |
| 2539476 | 10.1021/jm00124a005 | Human respirovirus 3 | 1 |
| 2539476 | 10.1021/jm00124a005 | Human rhinovirus 1A | 1 |
| 2539476 | 10.1021/jm00124a005 | Human alphaherpesvirus 2 | 1 |
| 2539476 | 10.1021/jm00124a005 | Human adenovirus 2 | 1 |
| 20921305 | 10.1128/aac.01029-10 | ADMET | 1 |
| 20921305 | 10.1128/aac.01029-10 | J774.A1 | 1 |
| 31931339 | 10.1016/j.ejmech.2019.112018 | Trypanosoma brucei brucei | 1 |
| 31931339 | 10.1016/j.ejmech.2019.112018 | Trypanosoma brucei rhodesiense | 1 |
| 31931339 | 10.1016/j.ejmech.2019.112018 | MRC5 | 1 |
Data from ChEMBL 36 via Core Engine