Compound Detail
CHEMBL5978097
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Basic Information
| ChEMBL ID | CHEMBL5978097 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JBYQGTSMKFBZHS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
310.4
MW (Da)
4.20
ALogP
5
HBA
0
HBD
57.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sphingosine 1-phosphate receptor 1 CHEMBL4333 | EC50 | 7.97 | 7.97 | 10.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sphingosine 1-phosphate receptor 1 | EC50 | = | 10.7 | nM | 7.97 | S1P1 assay: The method involves contacting the receptor with a suitable concentr... | - |
Data from ChEMBL 36 via Core Engine