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DocumentationIdentifier: MM325364
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325364 |
| SMILES |
CCC(=O)OC=C(F)C=O
|
| InChIKey |
WMCAGVJTRGYDNH-UHFFFAOYSA-N
|
| MW [Da] |
146.12
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM44357
Similarity: 0.7724
Similarity to MM44357
| Tanimoto metric | 0.7724 |
|---|---|
| Cosine metric | 0.8788 |
| Dice metric | 0.8716 |
| MW: | 132.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253321
Similarity: 0.7122
Similarity to MM253321
| Tanimoto metric | 0.7122 |
|---|---|
| Cosine metric | 0.8324 |
| Dice metric | 0.8319 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253320
Similarity: 0.6879
Similarity to MM253320
| Tanimoto metric | 0.6879 |
|---|---|
| Cosine metric | 0.8156 |
| Dice metric | 0.8151 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+236 more
