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DocumentationIdentifier: MM297286
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297286 |
| SMILES |
CC=CC(C)=C(C)OC=O
|
| InChIKey |
CJIOHJPQMAFOFE-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
2.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM297288
Similarity: 0.6507
Similarity to MM297288
| Tanimoto metric | 0.6507 |
|---|---|
| Cosine metric | 0.7887 |
| Dice metric | 0.7884 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159808
Similarity: 0.6239
Similarity to MM159808
| Tanimoto metric | 0.6239 |
|---|---|
| Cosine metric | 0.7899 |
| Dice metric | 0.7684 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM385084
Similarity: 0.6209
Similarity to MM385084
| Tanimoto metric | 0.6209 |
|---|---|
| Cosine metric | 0.7674 |
| Dice metric | 0.7661 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+201 more
