Compound Detail
CHEMBL5990661
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Basic Information
| ChEMBL ID | CHEMBL5990661 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DSDQKAJLESVGJN-UHFFFAOYSA-N |
4
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
466.6
MW (Da)
4.03
ALogP
8
HBA
0
HBD
77.7
PSA (Ų)
0.37
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 6.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Activin receptor type-1 CHEMBL5903 | IC50 | 6.25 | 6.25 | 562.0 | 2 |
| Activin receptor type-1-like CHEMBL5311 | IC50 | 6.2 | 6.2 | 632.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 6.2 | 6.2 | 632.0 | 1 |
| Bone morphogenetic protein receptor type-1A CHEMBL5275 | IC50 | 5.62 | 5.62 | 2372.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Activin receptor type-1 | IC50 | = | 562.0 | nM | 6.25 | ALK1-6 enzymatic assays: Specifically, compounds were assayed using LANCE® Ultra... | - |
| Activin receptor type-1 | IC50 | = | 562.0 | nM | 6.25 | Enzyme Assay: Compounds were assessed in ALK1-6 enzymatic assays. Specifically, ... | - |
| Unchecked | IC50 | = | 632.0 | nM | 6.2 | ALK1-6 enzymatic assays: Specifically, compounds were assayed using LANCE® Ultra... | - |
| Activin receptor type-1-like | IC50 | = | 632.0 | nM | 6.2 | Enzyme Assay: Compounds were assessed in ALK1-6 enzymatic assays. Specifically, ... | - |
| Bone morphogenetic protein receptor type-1A | IC50 | = | 2372.0 | nM | 5.62 | ALK1-6 enzymatic assays: Specifically, compounds were assayed using LANCE® Ultra... | - |
| Bone morphogenetic protein receptor type-1A | IC50 | = | 2372.0 | nM | 5.62 | Enzyme Assay: Compounds were assessed in ALK1-6 enzymatic assays. Specifically, ... | - |
Data from ChEMBL 36 via Core Engine