Compound Detail
CHEMBL157729
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Basic Information
| ChEMBL ID | CHEMBL157729 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RWXZXCZBMQPOBF-UHFFFAOYSA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
132.2
MW (Da)
1.87
ALogP
1
HBA
1
HBD
28.7
PSA (Ų)
0.58
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 |
|---|---|---|---|
| - | 10.1039/C5MD00293A | NON-PROTEIN TARGET | 2 |
| 7120277 | 10.1021/jm00350a002 | Cytochrome P450 2B1 | 1 |
| 7120277 | 10.1021/jm00350a002 | No relevant target | 1 |
| 7097715 | 10.1021/jm00348a003 | Cytochrome P450 1A1 | 1 |
| 7097715 | 10.1021/jm00348a003 | Cytochrome P450 2B1 | 1 |
| 17379526 | 10.1016/j.bmc.2007.03.010 | Xanthine dehydrogenase/oxidase | 1 |
| 24262887 | 10.1016/j.bmc.2013.10.037 | Indoleamine 2,3-dioxygenase 1 | 1 |
| - | 10.1039/C5MD00293A | CCRF-CEM | 1 |
| - | 10.1039/C5MD00293A | SR | 1 |
| - | 10.1039/C5MD00293A | MCF7 | 1 |
Data from ChEMBL 36 via Core Engine