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DocumentationIdentifier: MM329794
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM329794 |
| SMILES |
C=CC(=O)OC(C=C)CF
|
| InChIKey |
ZKUNMBHINTUWBD-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
1.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM150055
Similarity: 0.8333
Similarity to MM150055
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329463
Similarity: 0.7721
Similarity to MM329463
| Tanimoto metric | 0.7721 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.8714 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329461
Similarity: 0.6757
Similarity to MM329461
| Tanimoto metric | 0.6757 |
|---|---|
| Cosine metric | 0.8069 |
| Dice metric | 0.8065 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+227 more
