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DocumentationIdentifier: MM66357
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM66357 |
| SMILES |
C=CC(O)C(=O)CC(C)F
|
| InChIKey |
IDZUIBJSPCCFES-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM40809
Similarity: 0.7123
Similarity to MM40809
| Tanimoto metric | 0.7123 |
|---|---|
| Cosine metric | 0.844 |
| Dice metric | 0.832 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173242
Similarity: 0.6986
Similarity to MM173242
| Tanimoto metric | 0.6986 |
|---|---|
| Cosine metric | 0.8358 |
| Dice metric | 0.8226 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84994
Similarity: 0.5864
Similarity to MM84994
| Tanimoto metric | 0.5864 |
|---|---|
| Cosine metric | 0.7463 |
| Dice metric | 0.7393 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+153 more
