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DocumentationIdentifier: MM137676
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM137676 |
| SMILES |
C=CC(F)(F)C(O)C=O
|
| InChIKey |
DHZWWTJBALIGMG-UHFFFAOYSA-N
|
| MW [Da] |
136.1
Automatically obtained from RDkit software. |
| LogP |
0.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM233539
Similarity: 0.7908
Similarity to MM233539
| Tanimoto metric | 0.7908 |
|---|---|
| Cosine metric | 0.8893 |
| Dice metric | 0.8832 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM233540
Similarity: 0.7806
Similarity to MM233540
| Tanimoto metric | 0.7806 |
|---|---|
| Cosine metric | 0.8835 |
| Dice metric | 0.8768 |
| MW: | 154.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35439
Similarity: 0.7107
Similarity to MM35439
| Tanimoto metric | 0.7107 |
|---|---|
| Cosine metric | 0.8431 |
| Dice metric | 0.8309 |
| MW: | 118.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+270 more
