Compound Detail
CHEMBL1515447
HOMOCHLORCYCLIZINE 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL1515447 |
| Name | HOMOCHLORCYCLIZINE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | WEUCDJCFJHYFRL-UHFFFAOYSA-N |
6
Targets
8
Activities
2
Assay Types
0
PK Parameters
20
Publications
8
Known Names
Molecular Properties
314.9
MW (Da)
4.07
ALogP
2
HBA
0
HBD
6.5
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Activity Summary
IC50 5 meas. best 5.71
EC50 3 meas. best 7.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatitis C virus CHEMBL379 | EC50 | 7.24 | 7.24 | 57.0 | 1 |
| Trypanosoma brucei CHEMBL612849 | IC50 | 5.71 | 5.52 | 1940.0 | 2 |
| Trypanosoma cruzi CHEMBL368 | IC50 | 5.03 | 5.03 | 9440.0 | 1 |
| Trypanosoma cruzi CHEMBL368 | EC50 | 4.92 | 4.92 | 12000.0 | 1 |
| ADMET CHEMBL612558 | EC50 | 4.89 | 4.89 | 13000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.8 | 4.8 | 15650.3 | 1 |
| Leishmania infantum CHEMBL612848 | IC50 | 4.44 | 4.44 | 36320.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatitis C virus | EC50 | = | 57.0 | nM | 7.24 | Antiviral activity against HCV JFH-1 infected in Huh7.5.1 cells after 48 hrs by ... | 26599718 |
| Trypanosoma brucei | IC50 | = | 1940.0 | nM | 5.71 | AntiTrypanosoma brucei activity T. b. rhodesiense IC50 (uM) | - |
| Trypanosoma brucei | IC50 | = | 4640.0 | nM | 5.33 | AntiTrypanosoma brucei activity T. b. brucei IC50 (uM) | - |
| Trypanosoma cruzi | IC50 | = | 9440.0 | nM | 5.03 | AntiTrypanosoma cruzi activity IC50 (uM) | - |
| Trypanosoma cruzi | EC50 | = | 12000.0 | nM | 4.92 | Antitrypanosomal activity against Trypanosoma cruzi amastigotes infected in BESM... | 20547819 |
| ADMET | EC50 | = | 13000.0 | nM | 4.89 | Cytotoxicity against BESM cells after 88 hrs by HTS assay | 20547819 |
| Unchecked | IC50 | = | 15650.33 | nM | 4.8 | PubChem BioAssay. tonic K+ channel activity under 0.1 mM glucose conditions in I... | - |
| Leishmania infantum | IC50 | = | 36320.0 | nM | 4.44 | AntiLeishmania activity L. infantum (macrophages) IC50 (uM) | - |
Literature References
Data from ChEMBL 36 via Core Engine