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DocumentationIdentifier: MM160258
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM160258 |
| SMILES |
CC(=O)C(O)C(F)C=O
|
| InChIKey |
BOFQKPYGKISWCV-UHFFFAOYSA-N
|
| MW [Da] |
134.11
Automatically obtained from RDkit software. |
| LogP |
-0.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM34903
Similarity: 0.7227
Similarity to MM34903
| Tanimoto metric | 0.7227 |
|---|---|
| Cosine metric | 0.8501 |
| Dice metric | 0.839 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160267
Similarity: 0.6809
Similarity to MM160267
| Tanimoto metric | 0.6809 |
|---|---|
| Cosine metric | 0.8101 |
| Dice metric | 0.8101 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM225664
Similarity: 0.6761
Similarity to MM225664
| Tanimoto metric | 0.6761 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.8068 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+76 more
