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DocumentationIdentifier: MM130683
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM130683 |
| SMILES |
CC(F)(C=O)CC(F)F
|
| InChIKey |
NQURXUMSRAKQRI-UHFFFAOYSA-N
|
| MW [Da] |
140.1
Automatically obtained from RDkit software. |
| LogP |
1.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM103057
Similarity: 0.7529
Similarity to MM103057
| Tanimoto metric | 0.7529 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8591 |
| MW: | 122.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM222174
Similarity: 0.6538
Similarity to MM222174
| Tanimoto metric | 0.6538 |
|---|---|
| Cosine metric | 0.8086 |
| Dice metric | 0.7907 |
| MW: | 154.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229169
Similarity: 0.6489
Similarity to MM229169
| Tanimoto metric | 0.6489 |
|---|---|
| Cosine metric | 0.8055 |
| Dice metric | 0.787 |
| MW: | 151.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+338 more
