Compound Detail
CHEMBL4483740
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
Basic Information
| ChEMBL ID | CHEMBL4483740 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PGAUOMHMEJHMTO-AKAIJSEGSA-N |
12
Targets
15
Activities
2
Assay Types
0
PK Parameters
19
Publications
0
Known Names
Molecular Properties
321.3
MW (Da)
-0.20
ALogP
9
HBA
3
HBD
123.0
PSA (Ų)
0.61
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 13 meas. best 6.75
EC50 2 meas. best 6.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| CCRF-CEM CHEMBL382 | IC50 | 6.75 | 6.75 | 180.0 | 1 |
| HCT-116 CHEMBL394 | IC50 | 6.55 | 6.535 | 280.0 | 2 |
| Hepatitis C virus CHEMBL379 | EC50 | 6.54 | 6.48 | 290.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 6.52 | 6.015 | 300.0 | 2 |
| K562 CHEMBL385 | IC50 | 6.5 | 6.5 | 320.0 | 1 |
| U2OS CHEMBL615023 | IC50 | 6.37 | 6.37 | 430.0 | 1 |
| HL-60 CHEMBL383 | IC50 | 6.16 | 6.16 | 700.0 | 1 |
| BJ CHEMBL614358 | IC50 | 5.96 | 5.96 | 1090.0 | 1 |
| A549 CHEMBL392 | IC50 | 5.71 | 5.71 | 1930.0 | 1 |
| HeLa S3 CHEMBL4296436 | IC50 | 5.64 | 5.64 | 2310.0 | 1 |
| HepG2 CHEMBL395 | IC50 | 5.62 | 5.62 | 2410.0 | 1 |
| MRC5 CHEMBL614181 | IC50 | 4.87 | 4.87 | 13420.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine