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DocumentationIdentifier: MM351460
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351460 |
| SMILES |
C#CC(O)C(=O)C(F)CF
|
| InChIKey |
YEMORPUIWCPVBE-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM351458
Similarity: 0.6103
Similarity to MM351458
| Tanimoto metric | 0.6103 |
|---|---|
| Cosine metric | 0.758 |
| Dice metric | 0.758 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM50476
Similarity: 0.6047
Similarity to MM50476
| Tanimoto metric | 0.6047 |
|---|---|
| Cosine metric | 0.7776 |
| Dice metric | 0.7536 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350991
Similarity: 0.5961
Similarity to MM350991
| Tanimoto metric | 0.5961 |
|---|---|
| Cosine metric | 0.7483 |
| Dice metric | 0.7469 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+57 more
