Compound Detail
CHEMBL6027447
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CC[C@H](C)N1Cc2cc(-c3sc(Nc4cccc(N5CCCOC5=O)n4)nc3C)cc(S(=O)(=O)NC)c2C1=O
Basic Information
| ChEMBL ID | CHEMBL6027447 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NTZMWNKORQPPBL-HNNXBMFYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
570.7
MW (Da)
4.27
ALogP
9
HBA
2
HBD
133.8
PSA (Ų)
0.41
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform CHEMBL3130 | IC50 | 8.66 | 8.66 | 2.2 | 1 |
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform CHEMBL4005 | IC50 | 7.1 | 7.1 | 80.0 | 1 |
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform CHEMBL3145 | IC50 | 6.34 | 6.34 | 459.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine