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DocumentationIdentifier: MM244327
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244327 |
| SMILES |
CC(F)C(C)(C=O)C(C)F
|
| InChIKey |
RVDCGXFWUADOAZ-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139881
Similarity: 0.8095
Similarity to MM139881
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243731
Similarity: 0.6391
Similarity to MM243731
| Tanimoto metric | 0.6391 |
|---|---|
| Cosine metric | 0.7803 |
| Dice metric | 0.7798 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244322
Similarity: 0.6343
Similarity to MM244322
| Tanimoto metric | 0.6343 |
|---|---|
| Cosine metric | 0.7769 |
| Dice metric | 0.7763 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
