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DocumentationIdentifier: MM130938
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM130938 |
| SMILES |
C=CC(C)(C)C=C(F)F
|
| InChIKey |
QKBYVYVOPVSRLR-UHFFFAOYSA-N
|
| MW [Da] |
132.15
Automatically obtained from RDkit software. |
| LogP |
2.98
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM104794
Similarity: 0.7931
Similarity to MM104794
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM136279
Similarity: 0.746
Similarity to MM136279
| Tanimoto metric | 0.746 |
|---|---|
| Cosine metric | 0.8558 |
| Dice metric | 0.8545 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM150691
Similarity: 0.7419
Similarity to MM150691
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8519 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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