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DocumentationIdentifier: MM306696
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM306696 |
| SMILES |
CC(F)C(OC=O)C(C)F
|
| InChIKey |
SYMRCYPKQKMEGH-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
1.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179663
Similarity: 0.8364
Similarity to MM179663
| Tanimoto metric | 0.8364 |
|---|---|
| Cosine metric | 0.9145 |
| Dice metric | 0.9109 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305135
Similarity: 0.6458
Similarity to MM305135
| Tanimoto metric | 0.6458 |
|---|---|
| Cosine metric | 0.7868 |
| Dice metric | 0.7848 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243665
Similarity: 0.5935
Similarity to MM243665
| Tanimoto metric | 0.5935 |
|---|---|
| Cosine metric | 0.7494 |
| Dice metric | 0.7449 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+268 more
