Compound Detail
CHEMBL3728150
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
Cc1ccc(CCNC(=O)[C@H]2[C@H](C(=O)NCCCCN3CCCC3)[C@H]3C=C[C@@H]2C32CC2)cc1.O=CO
Basic Information
| ChEMBL ID | CHEMBL3728150 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CHFQNAZQSYMHPL-AVHAYRAPSA-N |
| Parent Compound | CHEMBL3733978 |
| Active Moiety | CHEMBL3733978 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
449.6
MW (Da)
3.47
ALogP
3
HBA
2
HBD
61.4
PSA (Ų)
0.42
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-formyl peptide receptor 3 CHEMBL5646 | EC50 | 7.52 | 7.52 | 30.0 | 1 |
| N-formyl peptide receptor 2 CHEMBL4227 | EC50 | 5.41 | 5.41 | 3900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-formyl peptide receptor 3 | EC50 | = | 30.0 | nM | 7.52 | Agonist activity at human recombinant FPRL2 receptor expressed in HEK293 cells c... | - |
| N-formyl peptide receptor 2 | EC50 | = | 3900.0 | nM | 5.41 | Agonist activity at human recombinant ALX receptor expressed in HEK293 cells co-... | - |
Data from ChEMBL 36 via Core Engine