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DocumentationIdentifier: MM325360
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325360 |
| SMILES |
CCC(=O)OC=C(C)C=O
|
| InChIKey |
GWINUDRBSJMMKA-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM146432
Similarity: 0.7647
Similarity to MM146432
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.8745 |
| Dice metric | 0.8667 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325715
Similarity: 0.6777
Similarity to MM325715
| Tanimoto metric | 0.6777 |
|---|---|
| Cosine metric | 0.8079 |
| Dice metric | 0.8079 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253265
Similarity: 0.6752
Similarity to MM253265
| Tanimoto metric | 0.6752 |
|---|---|
| Cosine metric | 0.8068 |
| Dice metric | 0.8061 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+388 more
