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DocumentationIdentifier: MM406761
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406761 |
| SMILES |
COCC(F)C(C=O)OC
|
| InChIKey |
UWJRHZMBJIPQMS-UHFFFAOYSA-N
|
| MW [Da] |
150.15
Automatically obtained from RDkit software. |
| LogP |
0.18
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: 0.689
Similarity to MM376564
| Tanimoto metric | 0.689 |
|---|---|
| Cosine metric | 0.8168 |
| Dice metric | 0.8159 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348553
Similarity: 0.6667
Similarity to MM348553
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8001 |
| Dice metric | 0.8 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111578
Similarity: 0.5758
Similarity to MM111578
| Tanimoto metric | 0.5758 |
|---|---|
| Cosine metric | 0.7588 |
| Dice metric | 0.7308 |
| MW: | 122.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+131 more
