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DocumentationIdentifier: MM253279
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253279 |
| SMILES |
C=CCC(=C)CC=C(F)F
|
| InChIKey |
HFXLIXJPGQQHGX-UHFFFAOYSA-N
|
| MW [Da] |
144.16
Automatically obtained from RDkit software. |
| LogP |
3.29
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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MM146377
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| Tanimoto metric | 0.9143 |
|---|---|
| Cosine metric | 0.9562 |
| Dice metric | 0.9552 |
| MW: | 132.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253218
Similarity: 0.7901
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| Tanimoto metric | 0.7901 |
|---|---|
| Cosine metric | 0.8833 |
| Dice metric | 0.8828 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.51 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM255941
Similarity: 0.7356
Similarity to MM255941
| Tanimoto metric | 0.7356 |
|---|---|
| Cosine metric | 0.8499 |
| Dice metric | 0.8477 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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