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DocumentationIdentifier: MM351180
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351180 |
| SMILES |
N#CC(O)C(=O)C(F)CF
|
| InChIKey |
KUIORIDMVLKHSM-UHFFFAOYSA-N
|
| MW [Da] |
149.1
Automatically obtained from RDkit software. |
| LogP |
-0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM82665
Similarity: 0.635
Similarity to MM82665
| Tanimoto metric | 0.635 |
|---|---|
| Cosine metric | 0.7771 |
| Dice metric | 0.7768 |
| MW: | 142.09 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350991
Similarity: 0.6244
Similarity to MM350991
| Tanimoto metric | 0.6244 |
|---|---|
| Cosine metric | 0.7697 |
| Dice metric | 0.7688 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223919
Similarity: 0.6019
Similarity to MM223919
| Tanimoto metric | 0.6019 |
|---|---|
| Cosine metric | 0.7515 |
| Dice metric | 0.7515 |
| MW: | 149.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+46 more
