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DocumentationIdentifier: MM24142
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM24142 |
| SMILES |
CC(=O)C=CF
|
| InChIKey |
GZKJIRORPWIMBN-UHFFFAOYSA-N
|
| MW [Da] |
88.08
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM26698
Similarity: 0.8205
Similarity to MM26698
| Tanimoto metric | 0.8205 |
|---|---|
| Cosine metric | 0.9058 |
| Dice metric | 0.9014 |
| MW: | 100.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107754
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| Tanimoto metric | 0.7442 |
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| Cosine metric | 0.8627 |
| Dice metric | 0.8533 |
| MW: | 118.08 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM25639
Similarity: 0.7273
Similarity to MM25639
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 106.07 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+217 more
