Compound Detail
CHEMBL399036
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Basic Information
| ChEMBL ID | CHEMBL399036 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NVEQFIOZRFFVFW-GUIRCDHDSA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
220.4
MW (Da)
3.94
ALogP
1
HBA
0
HBD
12.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1402962 | 10.1021/np50085a029 | Mus musculus | 6 |
| 1517737 | 10.1021/np50083a016 | NON-PROTEIN TARGET | 3 |
| 1517737 | 10.1021/np50083a016 | ZR-75-1 | 1 |
| 23062825 | 10.1016/j.bmc.2012.09.040 | Cholinesterase | 1 |
| 21438586 | 10.1021/np100415m | L6 | 1 |
| 21438586 | 10.1021/np100415m | Trypanosoma brucei rhodesiense | 1 |
| 21438586 | 10.1021/np100415m | Plasmodium falciparum | 1 |
| 17067156 | 10.1021/np0680174 | Cholinesterase | 1 |
| 1517737 | 10.1021/np50083a016 | KB | 1 |
| 1517737 | 10.1021/np50083a016 | LNCaP | 1 |
| 1517737 | 10.1021/np50083a016 | Lu1 | 1 |
| 1517737 | 10.1021/np50083a016 | SK-MEL-2 | 1 |
| 17845001 | 10.1021/np070293a | Plasmodium falciparum | 1 |
| 1517737 | 10.1021/np50083a016 | P388 | 1 |
| 1517737 | 10.1021/np50083a016 | HT-1080 | 1 |
| 1517737 | 10.1021/np50083a016 | Col2 | 1 |
| 1517737 | 10.1021/np50083a016 | A-431 | 1 |
| 17845001 | 10.1021/np070293a | NCI-H187 | 1 |
| 17845001 | 10.1021/np070293a | NON-PROTEIN TARGET | 1 |
| 17845001 | 10.1021/np070293a | KB | 1 |
Data from ChEMBL 36 via Core Engine