Compound Detail
CHEMBL1234613
NADIDE 🧪 Phase II
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🧪 Phase II
NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1
Basic Information
| ChEMBL ID | CHEMBL1234613 |
| Name | NADIDE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | BAWFJGJZGIEFAR-NNYOXOHSSA-N |
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
17
Known Names
Molecular Properties
663.4
MW (Da)
-3.65
ALogP
18
HBA
7
HBD
321.1
PSA (Ų)
0.08
QED
3
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Racemic |
Activity Summary
Kd 1 meas.
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20014752 | 10.1021/tx900326k | Hepatotoxicity | 3 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 16884311 | 10.1021/jm060490r | 2-dehydropantoate 2-reductase | 2 |
| 38318365 | 10.1016/j.isci.2024.108907 | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 1 |
| 8308865 | 10.1021/jm00029a011 | Alcohol dehydrogenase 1A | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B3 | 1 |
| 23571415 | 10.1124/mol.112.084152 | Solute carrier organic anion transporter family member 1B1 | 1 |
| 21528845 | 10.1021/jm1013852 | Unchecked | 1 |
| 21528845 | 10.1021/jm1013852 | NAD-dependent protein deacetylase sirtuin-1 | 1 |
| 16884314 | 10.1021/jm060479r | Inosine-5'-monophosphate dehydrogenase (IMPDH) | 1 |
| 2391679 | 10.1021/jm00171a002 | 17-beta-hydroxysteroid dehydrogenase type 1 | 1 |
| 7310833 | 10.1021/jm00144a035 | Choline O-acetyltransferase | 1 |
| 1969483 | 10.1021/jm00166a007 | Malate dehydrogenase, cytoplasmic | 1 |
| 1969483 | 10.1021/jm00166a007 | L-lactate dehydrogenase B chain | 1 |
| 1969483 | 10.1021/jm00166a007 | Alcohol dehydrogenase | 1 |
| 1969483 | 10.1021/jm00166a007 | Glutamate dehydrogenase 1, mitochondrial | 1 |
| 8308865 | 10.1021/jm00029a011 | Unchecked | 1 |
| 8308865 | 10.1021/jm00029a011 | L-lactate dehydrogenase A chain | 1 |
| 8308865 | 10.1021/jm00029a011 | Glutamate dehydrogenase 1, mitochondrial | 1 |
Data from ChEMBL 36 via Core Engine