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DocumentationIdentifier: MM35125
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM35125 |
| SMILES |
N#CC(O)(CF)CF
|
| InChIKey |
RKIFBAGPQRBVFB-UHFFFAOYSA-N
|
| MW [Da] |
121.09
Automatically obtained from RDkit software. |
| LogP |
0.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM97278
Similarity: 0.8033
Similarity to MM97278
| Tanimoto metric | 0.8033 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.8909 |
| MW: | 103.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111438
Similarity: 0.6712
Similarity to MM111438
| Tanimoto metric | 0.6712 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.8033 |
| MW: | 114.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139896
Similarity: 0.6559
Similarity to MM139896
| Tanimoto metric | 0.6559 |
|---|---|
| Cosine metric | 0.8099 |
| Dice metric | 0.7922 |
| MW: | 139.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+146 more
