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DocumentationIdentifier: MM222289
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222289 |
| SMILES |
CC(C)C(C)(C)C=C(F)F
|
| InChIKey |
DPAVBTQAZAULIT-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
3.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130899
Similarity: 0.7975
Similarity to MM130899
| Tanimoto metric | 0.7975 |
|---|---|
| Cosine metric | 0.893 |
| Dice metric | 0.8873 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132779
Similarity: 0.7848
Similarity to MM132779
| Tanimoto metric | 0.7848 |
|---|---|
| Cosine metric | 0.8859 |
| Dice metric | 0.8794 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134065
Similarity: 0.7722
Similarity to MM134065
| Tanimoto metric | 0.7722 |
|---|---|
| Cosine metric | 0.8787 |
| Dice metric | 0.8714 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+444 more
