Assay Detail
ADMET
CHEMBL916472
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Cytotoxicity against human CEM cells after 72 hrs by MTT assay
35
Total Activities
35
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | CCRF-CEM |
| Confidence | 1 — Organism |
| Curated By | Autocuration |
Publication
Triterpenoid pyrazines and benzopyrazines with cytotoxic activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 35 | 4.79 | 5.70 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL296567 | DIHYDROBETULONIC ACID | — | 1 | 5.70 |
| CHEMBL108505 | DIHYDROBETULINIC ACID | — | 1 | 5.16 |
| CHEMBL222760 | — | — | 1 | 5.10 |
| CHEMBL376049 | — | — | 1 | 4.92 |
| CHEMBL221890 | — | — | 1 | 4.85 |
| CHEMBL153117 | — | — | 1 | 4.80 |
| CHEMBL431525 | BETUNOLIC ACID | — | 1 | 4.70 |
| CHEMBL269277 | BETULINIC ACID | 1.0 | 1 | 4.52 |
| CHEMBL222526 | — | — | 1 | 4.46 |
| CHEMBL222651 | — | — | 1 | 4.38 |
| CHEMBL224818 | — | — | 1 | 4.13 |
| CHEMBL376864 | — | — | 1 | - |
| CHEMBL222479 | — | — | 1 | - |
| CHEMBL222586 | — | — | 1 | - |
| CHEMBL222428 | — | — | 1 | - |
| CHEMBL387323 | — | — | 1 | - |
| CHEMBL267420 | — | — | 1 | - |
| CHEMBL221422 | — | — | 1 | - |
| CHEMBL376208 | — | — | 1 | - |
| CHEMBL345734 | — | — | 1 | - |
| CHEMBL221836 | — | — | 1 | - |
| CHEMBL221835 | ALLOBETULONE | — | 1 | - |
| CHEMBL496855 | ALLOBETULIN | — | 1 | - |
| CHEMBL387150 | METHYL DIHYDROBETULONATE | — | 1 | - |
| CHEMBL376483 | — | — | 1 | - |
| CHEMBL373633 | — | — | 1 | - |
| CHEMBL23236 | BETULIN | — | 1 | - |
| CHEMBL376266 | METHYL BETULONATE | — | 1 | - |
| CHEMBL374317 | — | — | 1 | - |
| CHEMBL222239 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL296567 | DIHYDROBETULONIC ACID | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL108505 | DIHYDROBETULINIC ACID | IC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL222760 | — | IC50 | = | 8000.0 | nM | 5.10 |
| CHEMBL376049 | — | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL221890 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL153117 | — | IC50 | = | 16000.0 | nM | 4.80 |
| CHEMBL431525 | BETUNOLIC ACID | IC50 | = | 20000.0 | nM | 4.70 |
| CHEMBL269277 | BETULINIC ACID | IC50 | = | 30000.0 | nM | 4.52 |
| CHEMBL222526 | — | IC50 | = | 35000.0 | nM | 4.46 |
| CHEMBL222651 | — | IC50 | = | 42000.0 | nM | 4.38 |
| CHEMBL224818 | — | IC50 | = | 74000.0 | nM | 4.13 |
| CHEMBL221422 | — | IC50 | = | 244000.0 | nM | - |
| CHEMBL267420 | — | IC50 | = | 232000.0 | nM | - |
| CHEMBL387323 | — | IC50 | = | 106000.0 | nM | - |
| CHEMBL222428 | — | IC50 | = | 215000.0 | nM | - |
| CHEMBL222586 | — | IC50 | = | 151000.0 | nM | - |
| CHEMBL222479 | — | IC50 | = | 178000.0 | nM | - |
| CHEMBL376864 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL222652 | — | IC50 | = | 124000.0 | nM | - |
| CHEMBL374870 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL221372 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL375234 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL222703 | — | IC50 | = | 101000.0 | nM | - |
| CHEMBL376208 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL345734 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL221836 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL221835 | ALLOBETULONE | IC50 | = | 250000.0 | nM | - |
| CHEMBL496855 | ALLOBETULIN | IC50 | = | 250000.0 | nM | - |
| CHEMBL387150 | METHYL DIHYDROBETULONATE | IC50 | = | 173000.0 | nM | - |
| CHEMBL376483 | — | IC50 | = | 192000.0 | nM | - |
| CHEMBL373633 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL23236 | BETULIN | IC50 | = | 250000.0 | nM | - |
| CHEMBL376266 | METHYL BETULONATE | IC50 | = | 250000.0 | nM | - |
| CHEMBL374317 | — | IC50 | = | 250000.0 | nM | - |
| CHEMBL222239 | — | IC50 | = | 250000.0 | nM | - |