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DocumentationIdentifier: MM361853
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361853 |
| SMILES |
COCCC(F)C(O)CF
|
| InChIKey |
GXDATELFJGAQEV-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM49965
Similarity: 0.5703
Similarity to MM49965
| Tanimoto metric | 0.5703 |
|---|---|
| Cosine metric | 0.7284 |
| Dice metric | 0.7264 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362433
Similarity: 0.5655
Similarity to MM362433
| Tanimoto metric | 0.5655 |
|---|---|
| Cosine metric | 0.7233 |
| Dice metric | 0.7225 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362434
Similarity: 0.5655
Similarity to MM362434
| Tanimoto metric | 0.5655 |
|---|---|
| Cosine metric | 0.7233 |
| Dice metric | 0.7225 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+441 more
