Compound Detail
CHEMBL195520
PHOSPHORIC ACID MONOHYDRAZINOCARBONYLMETHYL ESTER Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL195520 |
| Name | PHOSPHORIC ACID MONOHYDRAZINOCARBONYLMETHYL ESTER |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OTQGCPIGFCJBDI-UHFFFAOYSA-N |
1
Targets
8
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
170.1
MW (Da)
-1.91
ALogP
4
HBA
4
HBD
121.9
PSA (Ų)
0.17
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 8 meas. best 6.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.47 | 6.47 | 340.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 340.0 | nM | 6.47 | Binding affinity against class II fructose-bisphosphate aldolase | 15911278 |
| Unchecked | Ki | = | 340.0 | nM | 6.47 | Inhibition of class II FBA | 17088060 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15125960 | 10.1016/j.bmcl.2004.03.040 | Unchecked | 5 |
| 17088060 | 10.1016/j.bmcl.2006.10.030 | Unchecked | 3 |
| 15911278 | 10.1016/j.bmcl.2005.03.061 | Unchecked | 1 |
| 15911278 | 10.1016/j.bmcl.2005.03.061 | Triosephosphate isomerase | 1 |
| 17088060 | 10.1016/j.bmcl.2006.10.030 | Triosephosphate isomerase | 1 |
Data from ChEMBL 36 via Core Engine