Compound Detail
CHEMBL2359490
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Basic Information
| ChEMBL ID | CHEMBL2359490 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NHCWZEQEFHNLBQ-HNCPQSOCSA-N |
| Parent Compound | CHEMBL1994494 |
| Active Moiety | CHEMBL1994494 |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
273.3
MW (Da)
1.74
ALogP
5
HBA
5
HBD
93.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.48 | 6.4425 | 33.2 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 33.16 | nM | 7.48 | PubChem BioAssay. RKO viability from Cell TiterGlo-IC50. (Class of assay: conf... | - |
| Unchecked | IC50 | = | 187.64 | nM | 6.73 | PubChem BioAssay. GSK3B-pretreated HCT116 viability from Cell TiterGlo-IC50. (... | - |
| Unchecked | IC50 | = | 466.19 | nM | 6.33 | PubChem BioAssay. Colo320 viability from Cell TiterGlo-IC50. (Class of assay: ... | - |
| Unchecked | IC50 | = | 5946.2 | nM | 5.23 | PubChem BioAssay. GLP1 secretion from NCI-H716 cells-IC50. (Class of assay: co... | - |
Data from ChEMBL 36 via Core Engine