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DocumentationIdentifier: MM79911
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM79911 |
| SMILES |
C=C(CF)CC(CO)OC
|
| InChIKey |
FXDUFESNVYNCHI-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142032
Similarity: 0.7442
Similarity to MM142032
| Tanimoto metric | 0.7442 |
|---|---|
| Cosine metric | 0.8627 |
| Dice metric | 0.8533 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262061
Similarity: 0.6358
Similarity to MM262061
| Tanimoto metric | 0.6358 |
|---|---|
| Cosine metric | 0.7781 |
| Dice metric | 0.7773 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245989
Similarity: 0.6225
Similarity to MM245989
| Tanimoto metric | 0.6225 |
|---|---|
| Cosine metric | 0.7684 |
| Dice metric | 0.7673 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
