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DocumentationIdentifier: MM334492
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM334492 |
| SMILES |
C=CC(=O)OC(C=O)=CF
|
| InChIKey |
ZEFXNCMQFAHBIF-UHFFFAOYSA-N
|
| MW [Da] |
144.1
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143202
Similarity: 0.7518
Similarity to MM143202
| Tanimoto metric | 0.7518 |
|---|---|
| Cosine metric | 0.8671 |
| Dice metric | 0.8583 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264584
Similarity: 0.7351
Similarity to MM264584
| Tanimoto metric | 0.7351 |
|---|---|
| Cosine metric | 0.8482 |
| Dice metric | 0.8473 |
| MW: | 144.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142842
Similarity: 0.7153
Similarity to MM142842
| Tanimoto metric | 0.7153 |
|---|---|
| Cosine metric | 0.8458 |
| Dice metric | 0.834 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+21 more
