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DocumentationIdentifier: MM52193
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM52193 |
| SMILES |
C=COC(C=O)C(C)F
|
| InChIKey |
WXDZJGJFKBNJKB-UHFFFAOYSA-N
|
| MW [Da] |
132.13
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM376564
Similarity: 0.7724
Similarity to MM376564
| Tanimoto metric | 0.7724 |
|---|---|
| Cosine metric | 0.8789 |
| Dice metric | 0.8716 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377009
Similarity: 0.732
Similarity to MM377009
| Tanimoto metric | 0.732 |
|---|---|
| Cosine metric | 0.8556 |
| Dice metric | 0.8453 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108126
Similarity: 0.6518
Similarity to MM108126
| Tanimoto metric | 0.6518 |
|---|---|
| Cosine metric | 0.8073 |
| Dice metric | 0.7892 |
| MW: | 118.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+319 more
