Compound Detail
CHEMBL5423612
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Basic Information
| ChEMBL ID | CHEMBL5423612 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MVFMGXXYJDHANY-LURJTMIESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
221.7
MW (Da)
0.37
ALogP
3
HBA
4
HBD
99.2
PSA (Ų)
0.22
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 CHEMBL6036 | Ki | 6.72 | 6.72 | 190.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 | Ki | = | 190.0 | nM | 6.72 | Inhibition of N-terminal His6-tagged human DDAH1 expressed in Escherichia coli B... | 36063653 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36063653 | 10.1016/j.bmc.2022.116970 | Unchecked | 1 |
| 36063653 | 10.1016/j.bmc.2022.116970 | N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 | 1 |
Data from ChEMBL 36 via Core Engine