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DocumentationIdentifier: MM334470
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334470 |
| SMILES |
C=CC(=C)OC(C=C)=CF
|
| InChIKey |
VASTWBWMPBFPCA-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
2.7
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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| Tanimoto metric | 0.93 |
|---|---|
| Cosine metric | 0.9637 |
| Dice metric | 0.9637 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM150556
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| Tanimoto metric | 0.9167 |
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| Cosine metric | 0.9574 |
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| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM143197
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Similarity to MM143197
| Tanimoto metric | 0.8854 |
|---|---|
| Cosine metric | 0.941 |
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| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+169 more
