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DocumentationIdentifier: MM456131
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM456131 |
| SMILES |
COC(C=CC1CC1)=CF
|
| InChIKey |
XYOIJFWEDOLSLK-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM344252
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| Tanimoto metric | 0.8016 |
|---|---|
| Cosine metric | 0.8953 |
| Dice metric | 0.8899 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM428670
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| Tanimoto metric | 0.7857 |
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| Cosine metric | 0.8864 |
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| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM209425
Similarity: 0.7619
Similarity to MM209425
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8649 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+242 more
