Compound Detail
CHEMBL2075007
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Basic Information
| ChEMBL ID | CHEMBL2075007 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NELLUUAGFXJBKY-GFCCVEGCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
267.4
MW (Da)
1.60
ALogP
4
HBA
1
HBD
55.4
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Solute carrier family 22 member 6 CHEMBL1777665 | Ki | 6.4 | 6.4 | 400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Solute carrier family 22 member 6 | Ki | = | 400.0 | nM | 6.4 | TP_TRANSPORTER: inhibition of PAH uptake in Xenopus laevis oocytes | 11641438 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11641438 | 10.1124/mol.60.5.1091 | Solute carrier family 22 member 6 | 2 |
Data from ChEMBL 36 via Core Engine