Compound Detail
CHEMBL505734
NOCARDAMINE Enter ChEMBL ID:
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O=C1CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN1
Basic Information
| ChEMBL ID | CHEMBL505734 |
| Name | NOCARDAMINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NHKCCADZVLTPPO-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
19
Publications
0
Known Names
Molecular Properties
600.7
MW (Da)
0.85
ALogP
9
HBA
6
HBD
208.9
PSA (Ų)
0.22
QED
2
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.65
IC50 1 meas. best 4.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.66 | 4.66 | 22000.0 | 1 |
| No relevant target CHEMBL2362975 | EC50 | 4.65 | 4.65 | 22400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 22000.0 | nM | 4.66 | Inhibition of BMI1 promoter in HEK293T cells incubated for 24 hrs by luciferase ... | 31079965 |
| No relevant target | EC50 | = | 22400.0 | nM | 4.65 | Binding affinity to Fe3+ assessed as compound-Fe3+ complex formation incubated f... | 33983744 |
Literature References
Data from ChEMBL 36 via Core Engine