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DocumentationIdentifier: MM111432
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM111432 |
| SMILES |
C#CC(F)(CO)CF
|
| InChIKey |
FSWVBDLUZKWISW-UHFFFAOYSA-N
|
| MW [Da] |
120.1
Automatically obtained from RDkit software. |
| LogP |
0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42577
Similarity: 0.622
Similarity to MM42577
| Tanimoto metric | 0.622 |
|---|---|
| Cosine metric | 0.7887 |
| Dice metric | 0.767 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM25741
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Similarity to MM25741
| Tanimoto metric | 0.6203 |
|---|---|
| Cosine metric | 0.7876 |
| Dice metric | 0.7656 |
| MW: | 102.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM311759
Similarity: 0.5896
Similarity to MM311759
| Tanimoto metric | 0.5896 |
|---|---|
| Cosine metric | 0.7678 |
| Dice metric | 0.7418 |
| MW: | 145.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+393 more
