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DocumentationIdentifier: MM276312
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM276312 |
| SMILES |
CC(=O)OC(C#N)=C(F)F
|
| InChIKey |
AZKFMZKVHXRXJW-UHFFFAOYSA-N
|
| MW [Da] |
147.08
Automatically obtained from RDkit software. |
| LogP |
1.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM150564
Similarity: 0.8029
Similarity to MM150564
| Tanimoto metric | 0.8029 |
|---|---|
| Cosine metric | 0.8961 |
| Dice metric | 0.8907 |
| MW: | 129.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134432
Similarity: 0.7153
Similarity to MM134432
| Tanimoto metric | 0.7153 |
|---|---|
| Cosine metric | 0.8458 |
| Dice metric | 0.834 |
| MW: | 136.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM80728
Similarity: 0.6707
Similarity to MM80728
| Tanimoto metric | 0.6707 |
|---|---|
| Cosine metric | 0.803 |
| Dice metric | 0.8029 |
| MW: | 145.09 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+62 more
