Compound Detail
CHEMBL1481347
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Basic Information
| ChEMBL ID | CHEMBL1481347 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FMEVPWMERPCLCQ-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1622994 |
| Active Moiety | CHEMBL1622994 |
9
Targets
29
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
314.5
MW (Da)
5.09
ALogP
2
HBA
1
HBD
28.8
PSA (Ų)
0.62
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 18 meas. best 6.68
IC50 11 meas. best 6.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.68 | 5.2313 | 210.0 | 8 |
| Sphingosine 1-phosphate receptor 2 CHEMBL2955 | IC50 | 6.48 | 6.005 | 333.0 | 2 |
| BJ CHEMBL614358 | EC50 | 6.15 | 5.6225 | 706.0 | 4 |
| Unchecked CHEMBL612545 | IC50 | 5.89 | 5.2329 | 1290.0 | 7 |
| Protein RecA CHEMBL1741171 | EC50 | 5.74 | 5.74 | 1830.0 | 1 |
| Streptokinase A CHEMBL1293228 | EC50 | 5.31 | 5.17 | 4855.0 | 2 |
| Streptococcus sp. 'group A' CHEMBL612389 | EC50 | 5.25 | 5.25 | 5581.0 | 1 |
| Calpain-2 catalytic subunit CHEMBL4143 | IC50 | 5.17 | 5.17 | 6719.0 | 1 |
| Streptococcus CHEMBL612313 | EC50 | 5.05 | 5.05 | 8862.0 | 1 |
| No relevant target CHEMBL2362975 | EC50 | 4.8 | 4.8 | 15801.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine