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DocumentationIdentifier: MM266171
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM266171 |
| SMILES |
C=CC=C(C)OC(=O)C=C
|
| InChIKey |
LHAXZAUDJYMCHP-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143201
Similarity: 0.839
Similarity to MM143201
| Tanimoto metric | 0.839 |
|---|---|
| Cosine metric | 0.916 |
| Dice metric | 0.9124 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM136124
Similarity: 0.7881
Similarity to MM136124
| Tanimoto metric | 0.7881 |
|---|---|
| Cosine metric | 0.8878 |
| Dice metric | 0.8815 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM334484
Similarity: 0.7254
Similarity to MM334484
| Tanimoto metric | 0.7254 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8408 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+197 more
