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DocumentationIdentifier: MM275144
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275144 |
| SMILES |
CC(=O)OC(C#N)C(F)F
|
| InChIKey |
HMOZTYLMYKZJLQ-UHFFFAOYSA-N
|
| MW [Da] |
149.1
Automatically obtained from RDkit software. |
| LogP |
0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM44508
Similarity: 0.7734
Similarity to MM44508
| Tanimoto metric | 0.7734 |
|---|---|
| Cosine metric | 0.8795 |
| Dice metric | 0.8722 |
| MW: | 131.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133596
Similarity: 0.6953
Similarity to MM133596
| Tanimoto metric | 0.6953 |
|---|---|
| Cosine metric | 0.8339 |
| Dice metric | 0.8203 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM116095
Similarity: 0.5391
Similarity to MM116095
| Tanimoto metric | 0.5391 |
|---|---|
| Cosine metric | 0.7342 |
| Dice metric | 0.7005 |
| MW: | 117.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+29 more
