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DocumentationIdentifier: MM272821
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272821 |
| SMILES |
CC(=O)OC(C=O)C=CF
|
| InChIKey |
ZUGFZZSSCNBHAU-UHFFFAOYSA-N
|
| MW [Da] |
146.12
Automatically obtained from RDkit software. |
| LogP |
0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM330324
Similarity: 0.6275
Similarity to MM330324
| Tanimoto metric | 0.6275 |
|---|---|
| Cosine metric | 0.7714 |
| Dice metric | 0.7711 |
| MW: | 144.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264142
Similarity: 0.6118
Similarity to MM264142
| Tanimoto metric | 0.6118 |
|---|---|
| Cosine metric | 0.76 |
| Dice metric | 0.7592 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243398
Similarity: 0.5864
Similarity to MM243398
| Tanimoto metric | 0.5864 |
|---|---|
| Cosine metric | 0.7393 |
| Dice metric | 0.7393 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+27 more
