Compound Detail
CHEMBL46931
ORTHOCRESOL Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL46931 |
| Name | ORTHOCRESOL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
0
Targets
6
Activities
2
Assay Types
0
PK Parameters
15
Publications
5
Known Names
Molecular Properties
108.1
MW (Da)
1.70
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
EC50 5 meas.
IC50 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17418579 | 10.1016/j.bmc.2007.03.040 | ADMET | 5 |
| 16279782 | 10.1021/jm050567w | L1210 | 4 |
| 6802973 | 10.1021/jm00345a016 | No relevant target | 3 |
| 30568753 | 10.1039/C8MD00436F | Unchecked | 3 |
| 6802973 | 10.1021/jm00345a016 | Bacillus subtilis | 2 |
| 2033592 | 10.1021/jm00109a021 | ADMET | 1 |
| 15857133 | 10.1021/jm048980b | No relevant target | 1 |
| 17418579 | 10.1016/j.bmc.2007.03.040 | No relevant target | 1 |
| 17300161 | 10.1021/jm0611105 | No relevant target | 1 |
| 17300161 | 10.1021/jm0611105 | Skin | 1 |
| 17300161 | 10.1021/jm0611105 | ADMET | 1 |
| 18412324 | 10.1021/jm701561e | No relevant target | 1 |
| 818381 | 10.1021/jm00227a004 | Aspergillus niger | 1 |
| 30568753 | 10.1039/C8MD00436F | U-87 MG | 1 |
| 30568753 | 10.1039/C8MD00436F | U-251 | 1 |
Data from ChEMBL 36 via Core Engine