Compound Detail
CHEMBL3666735
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Basic Information
| ChEMBL ID | CHEMBL3666735 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZLDWKGLZZIHBTD-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
463.6
MW (Da)
4.95
ALogP
6
HBA
3
HBD
98.8
PSA (Ų)
0.33
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rho-associated protein kinase 2 CHEMBL2973 | IC50 | 10.44 | 10.44 | 0.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rho-associated protein kinase 2 | IC50 | = | 0.036 | nM | 10.44 | Binding Assay: ROCK-II inhibitory activity can be measured using the ROCK-II Ass... | - |
Data from ChEMBL 36 via Core Engine