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DocumentationIdentifier: MM223079
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223079 |
| SMILES |
CC(O)CC(F)CC(F)F
|
| InChIKey |
QBTCAUUNDKPBFE-UHFFFAOYSA-N
|
| MW [Da] |
156.15
Automatically obtained from RDkit software. |
| LogP |
1.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135070
Similarity: 0.8085
Similarity to MM135070
| Tanimoto metric | 0.8085 |
|---|---|
| Cosine metric | 0.8992 |
| Dice metric | 0.8941 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221674
Similarity: 0.7328
Similarity to MM221674
| Tanimoto metric | 0.7328 |
|---|---|
| Cosine metric | 0.8475 |
| Dice metric | 0.8458 |
| MW: | 156.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135074
Similarity: 0.7234
Similarity to MM135074
| Tanimoto metric | 0.7234 |
|---|---|
| Cosine metric | 0.8505 |
| Dice metric | 0.8395 |
| MW: | 142.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+464 more
