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DocumentationIdentifier: MM393163
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM393163 |
| SMILES |
C=CCOC(CO)C(=C)F
|
| InChIKey |
DAAFODATTSOWEA-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179834
Similarity: 0.8852
Similarity to MM179834
| Tanimoto metric | 0.8852 |
|---|---|
| Cosine metric | 0.9409 |
| Dice metric | 0.9391 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM392960
Similarity: 0.8358
Similarity to MM392960
| Tanimoto metric | 0.8358 |
|---|---|
| Cosine metric | 0.9106 |
| Dice metric | 0.9106 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM341079
Similarity: 0.697
Similarity to MM341079
| Tanimoto metric | 0.697 |
|---|---|
| Cosine metric | 0.8247 |
| Dice metric | 0.8214 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+283 more
