Compound Detail
CHEMBL478903
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Basic Information
| ChEMBL ID | CHEMBL478903 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SRRYQFIUUUZPJQ-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
475.5
MW (Da)
6.05
ALogP
7
HBA
1
HBD
82.6
PSA (Ų)
0.32
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| MC3T3-E1 CHEMBL4296463 | EC50 | 6.39 | 6.32 | 410.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| MC3T3-E1 | EC50 | = | 410.0 | nM | 6.39 | Induction of osteogenesis in mouse MC3T3-E1 cells assessed as osteocalcin secret... | 19179072 |
| MC3T3-E1 | EC50 | = | 510.0 | nM | 6.29 | Induction of osteogenesis in mouse MC3T3-E1 cells assessed as calcium level at 2... | 19179072 |
| MC3T3-E1 | EC50 | = | 520.0 | nM | 6.28 | Induction of osteogenesis in mouse MC3T3-E1 cells assessed as alkaline phosphata... | 19179072 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19179072 | 10.1016/j.bmcl.2009.01.025 | MC3T3-E1 | 3 |
Data from ChEMBL 36 via Core Engine