Compound Detail
CHEMBL145704
BROMCRESOL GREEN Enter ChEMBL ID:
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Cc1c(C2(c3cc(Br)c(O)c(Br)c3C)OS(=O)(=O)c3ccccc32)cc(Br)c(O)c1Br
Basic Information
| ChEMBL ID | CHEMBL145704 |
| Name | BROMCRESOL GREEN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FRPHFZCDPYBUAU-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
698.0
MW (Da)
6.78
ALogP
5
HBA
2
HBD
83.8
PSA (Ų)
0.29
QED
2
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Solute carrier organic anion transporter family member 2A1 CHEMBL2073680 | Ki | 5.44 | 5.44 | 3600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Solute carrier organic anion transporter family member 2A1 | Ki | = | 3600.0 | nM | 5.44 | TP_TRANSPORTER: inhibition of PGF2alpha uptake in PGT-expressing HeLa cells | 7754369 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9871602 | 10.1016/s0960-894x(98)00056-0 | Cavia porcellus | 2 |
| 7754369 | 10.1126/science.7754369 | Solute carrier organic anion transporter family member 2A1 | 1 |
| 10462545 | 10.1124/mol.56.3.570 | Solute carrier family 22 member 6 | 1 |
Data from ChEMBL 36 via Core Engine