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DocumentationIdentifier: MM233098
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233098 |
| SMILES |
CC(F)(CCF)C(O)CO
|
| InChIKey |
TWGSOWUBQDPIJF-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
0.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41473
Similarity: 0.7365
Similarity to MM41473
| Tanimoto metric | 0.7365 |
|---|---|
| Cosine metric | 0.8582 |
| Dice metric | 0.8482 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132575
Similarity: 0.7095
Similarity to MM132575
| Tanimoto metric | 0.7095 |
|---|---|
| Cosine metric | 0.8423 |
| Dice metric | 0.83 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM319562
Similarity: 0.6813
Similarity to MM319562
| Tanimoto metric | 0.6813 |
|---|---|
| Cosine metric | 0.8145 |
| Dice metric | 0.8104 |
| MW: | 150.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
