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DocumentationIdentifier: MM282411
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM282411 |
| SMILES |
CC=CC(=O)C=COC=O
|
| InChIKey |
BDIJUZJOQQCDNJ-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
0.82
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM158209
Similarity: 0.8295
Similarity to MM158209
| Tanimoto metric | 0.8295 |
|---|---|
| Cosine metric | 0.9108 |
| Dice metric | 0.9068 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM282389
Similarity: 0.7426
Similarity to MM282389
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8523 |
| Dice metric | 0.8523 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM282410
Similarity: 0.7374
Similarity to MM282410
| Tanimoto metric | 0.7374 |
|---|---|
| Cosine metric | 0.8491 |
| Dice metric | 0.8488 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+207 more
