Compound Detail
CHEMBL1200667
ENCLOMIPHENE CITRATE 🧪 Phase III
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🧪 Phase III
CCN(CC)CCOc1ccc(/C(=C(/Cl)c2ccccc2)c2ccccc2)cc1.O=C(O)CC(O)(CC(=O)O)C(=O)O
Basic Information
| ChEMBL ID | CHEMBL1200667 |
| Name | ENCLOMIPHENE CITRATE |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | PYTMYKVIJXPNBD-BTKVJIOYSA-N |
| Parent Compound | CHEMBL954 |
| Active Moiety | CHEMBL1056 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
6
Known Names
4
Indications
Molecular Properties
406.0
MW (Da)
6.56
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Indications
Hypogonadism Hypogonadism Polycystic Ovary Syndrome Infertility
Activity Summary
IC50 1 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium CHEMBL4888483 | IC50 | 6.66 | 6.66 | 220.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium | IC50 | = | 220.0 | nM | 6.66 | Antimalarial activity against Plasmodium | 32283298 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20553011 | 10.1021/tx1000865 | Hepatotoxicity | 1 |
| - | 10.1101/2020.04.03.023846 | SARS-CoV-2 | 1 |
| 32283298 | 10.1016/j.ejmech.2020.112275 | Plasmodium | 1 |
Data from ChEMBL 36 via Core Engine