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DocumentationIdentifier: MM15754
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM15754 |
| SMILES |
O=CCCC(F)(F)CC=O
|
| InChIKey |
KLBWRUZKSUWVCU-UHFFFAOYSA-N
|
| MW [Da] |
150.12
Automatically obtained from RDkit software. |
| LogP |
1.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132366
Similarity: 0.8765
Similarity to MM132366
| Tanimoto metric | 0.8765 |
|---|---|
| Cosine metric | 0.9362 |
| Dice metric | 0.9342 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM138210
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| Tanimoto metric | 0.8395 |
|---|---|
| Cosine metric | 0.9162 |
| Dice metric | 0.9128 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
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|---|---|---|---|---|---|
| AI: | 0
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MM233881
Similarity: 0.6923
Similarity to MM233881
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8208 |
| Dice metric | 0.8182 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+311 more
