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DocumentationIdentifier: MM106256
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM106256 |
| SMILES |
CC(F)C=COC=O
|
| InChIKey |
VMORULHLEXWXOB-UHFFFAOYSA-N
|
| MW [Da] |
118.11
Automatically obtained from RDkit software. |
| LogP |
1.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169704
Similarity: 0.8082
Similarity to MM169704
| Tanimoto metric | 0.8082 |
|---|---|
| Cosine metric | 0.899 |
| Dice metric | 0.8939 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM131842
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| Tanimoto metric | 0.7763 |
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| Cosine metric | 0.8811 |
| Dice metric | 0.8741 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM169540
Similarity: 0.7662
Similarity to MM169540
| Tanimoto metric | 0.7662 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.8676 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+289 more
