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DocumentationIdentifier: MM341459
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM341459 |
| SMILES |
C=CC(C=C)OCC(=C)F
|
| InChIKey |
ZPLMALKZLFPZEY-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM144497
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| Tanimoto metric | 0.8987 |
|---|---|
| Cosine metric | 0.948 |
| Dice metric | 0.9467 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM199183
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| Tanimoto metric | 0.7595 |
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| Cosine metric | 0.8715 |
| Dice metric | 0.8633 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM162327
Similarity: 0.7053
Similarity to MM162327
| Tanimoto metric | 0.7053 |
|---|---|
| Cosine metric | 0.8274 |
| Dice metric | 0.8272 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+198 more
