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DocumentationIdentifier: MM326741
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM326741 |
| SMILES |
COC(C=O)CC(F)CO
|
| InChIKey |
WHSJDFGFRDGJMT-UHFFFAOYSA-N
|
| MW [Da] |
150.15
Automatically obtained from RDkit software. |
| LogP |
-0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM44410
Similarity: 0.7752
Similarity to MM44410
| Tanimoto metric | 0.7752 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8734 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141669
Similarity: 0.7287
Similarity to MM141669
| Tanimoto metric | 0.7287 |
|---|---|
| Cosine metric | 0.8536 |
| Dice metric | 0.843 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326746
Similarity: 0.6329
Similarity to MM326746
| Tanimoto metric | 0.6329 |
|---|---|
| Cosine metric | 0.7752 |
| Dice metric | 0.7752 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+132 more
