Compound Detail
CHEMBL5935453
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
C[C@H](CO)NC(=O)c1nc(OC[C@H]2CCCO2)nc(N2CCC(COc3cc(-c4cn(C)cn4)cnc3N)CC2)n1
Basic Information
| ChEMBL ID | CHEMBL5935453 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DZVRVWVHBSNBDD-YLJYHZDGSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
567.6
MW (Da)
1.21
ALogP
13
HBA
3
HBD
175.7
PSA (Ų)
0.30
QED
2
Ro5 Violations
11
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 10.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO CHEMBL4895 | Ki | 10.92 | 10.545 | 0.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase receptor UFO | Ki | = | 0.012 | nM | 10.92 | Enzyme Assay: AXL enzyme inhibition (% inhibition, Kiapp and Ki values) by small... | - |
| Tyrosine-protein kinase receptor UFO | Ki | = | 0.068 | nM | 10.17 | Enzyme Assay: AXL enzyme inhibition (% inhibition, Kiapp and Ki values) by small... | - |
Data from ChEMBL 36 via Core Engine