Synonyms: | |
Status: | Phase 2 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | DW94IAT0LS |
InChI Key | XTKLTGBKIDQGQL-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C22H22F3N3O3 |
Molecular Weight | 433.43 |
AlogP | 4.26 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 4.0 |
Polar Surface Area | 67.59 |
Molecular species | ACID |
Aromatic Rings | 3.0 |
Heavy Atoms | 31.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Transferase
|
23-178 | 1-48 | - | - | - | |
Enzyme
|
23-178 | 1-48 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Multiple Myeloma | 2 | D009101 | ClinicalTrials |
Neoplasms | 1 | D009369 | ClinicalTrials |
Stomach Neoplasms | 1 | D013274 | ClinicalTrials |
Melanoma | 1 | D008545 | ClinicalTrials |
Neoplasms | 1 | D009369 | ClinicalTrials |
Resources | Reference |
---|---|
ChEMBL | CHEMBL3188551 |
DrugBank | DB11795 |
EPA CompTox | DTXSID10160124 |
FDA SRS | DW94IAT0LS |
Guide to Pharmacology | 7967 |
PubChem | 56949517 |
SureChEMBL | SCHEMBL1280998 |
ZINC | ZINC000077024226 |