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DocumentationIdentifier: MM245989
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245989 |
| SMILES |
C=C(CC(O)CO)C(F)F
|
| InChIKey |
FDKMFGDWPYSHTR-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
0.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133816
Similarity: 0.7931
Similarity to MM133816
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM321990
Similarity: 0.6552
Similarity to MM321990
| Tanimoto metric | 0.6552 |
|---|---|
| Cosine metric | 0.8094 |
| Dice metric | 0.7917 |
| MW: | 136.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM79911
Similarity: 0.6225
Similarity to MM79911
| Tanimoto metric | 0.6225 |
|---|---|
| Cosine metric | 0.7684 |
| Dice metric | 0.7673 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+432 more
