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DocumentationIdentifier: MM348828
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348828 |
| SMILES |
O=C(CF)C(O)C(F)CO
|
| InChIKey |
WJOODVRERLMKGN-UHFFFAOYSA-N
|
| MW [Da] |
154.11
Automatically obtained from RDkit software. |
| LogP |
-0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160157
Similarity: 0.7484
Similarity to MM160157
| Tanimoto metric | 0.7484 |
|---|---|
| Cosine metric | 0.8651 |
| Dice metric | 0.8561 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348826
Similarity: 0.6505
Similarity to MM348826
| Tanimoto metric | 0.6505 |
|---|---|
| Cosine metric | 0.7888 |
| Dice metric | 0.7883 |
| MW: | 152.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253969
Similarity: 0.623
Similarity to MM253969
| Tanimoto metric | 0.623 |
|---|---|
| Cosine metric | 0.768 |
| Dice metric | 0.7677 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+117 more
