Compound Detail
CHEMBL463442
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C[C@H]1CC[C@H]2C(C)(C)CCC[C@]23Oc2ccc(OC(=S)N(C)C)cc2C[C@]13C
Basic Information
| ChEMBL ID | CHEMBL463442 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DRTPUUQCYHYPIT-FOEAQLGISA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
401.6
MW (Da)
5.85
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.55
QED
1
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11975483 | 10.1021/np010471e | Mycobacterium tuberculosis | 3 |
| 11975483 | 10.1021/np010471e | Unchecked | 2 |
| 11975483 | 10.1021/np010471e | Plasmodium falciparum | 1 |
| 11975483 | 10.1021/np010471e | 5-hydroxytryptamine receptor 2A | 1 |
| 11975483 | 10.1021/np010471e | 5-hydroxytryptamine receptor 2C | 1 |
| 11975483 | 10.1021/np010471e | Vero | 1 |
Data from ChEMBL 36 via Core Engine