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DocumentationIdentifier: MM269909
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM269909 |
| SMILES |
CC(=CF)C(=O)CC(C)F
|
| InChIKey |
NLGYABIPLQOEMQ-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133978
Similarity: 0.7305
Similarity to MM133978
| Tanimoto metric | 0.7305 |
|---|---|
| Cosine metric | 0.8547 |
| Dice metric | 0.8443 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174859
Similarity: 0.7163
Similarity to MM174859
| Tanimoto metric | 0.7163 |
|---|---|
| Cosine metric | 0.8464 |
| Dice metric | 0.8347 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174858
Similarity: 0.6738
Similarity to MM174858
| Tanimoto metric | 0.6738 |
|---|---|
| Cosine metric | 0.8208 |
| Dice metric | 0.8051 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+267 more
