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DocumentationIdentifier: MM320242
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM320242 |
| SMILES |
N#CC(F)C(F)(C=O)C=O
|
| InChIKey |
DADIPIFRHUHHML-UHFFFAOYSA-N
|
| MW [Da] |
147.08
Automatically obtained from RDkit software. |
| LogP |
-0.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM320244
Similarity: 0.6441
Similarity to MM320244
| Tanimoto metric | 0.6441 |
|---|---|
| Cosine metric | 0.786 |
| Dice metric | 0.7835 |
| MW: | 144.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM319966
Similarity: 0.6298
Similarity to MM319966
| Tanimoto metric | 0.6298 |
|---|---|
| Cosine metric | 0.7761 |
| Dice metric | 0.7729 |
| MW: | 151.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM42378
Similarity: 0.6269
Similarity to MM42378
| Tanimoto metric | 0.6269 |
|---|---|
| Cosine metric | 0.7917 |
| Dice metric | 0.7706 |
| MW: | 129.09 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+10 more
