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DocumentationIdentifier: MM264582
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264582 |
| SMILES |
C=C(C=O)OC(=O)C=CC
|
| InChIKey |
VIDQWJSCKKWRES-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
MM142842
Similarity: 0.8099
Similarity to MM142842
| Tanimoto metric | 0.8099 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.895 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135885
Similarity: 0.7686
Similarity to MM135885
| Tanimoto metric | 0.7686 |
|---|---|
| Cosine metric | 0.8767 |
| Dice metric | 0.8692 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM334488
Similarity: 0.7114
Similarity to MM334488
| Tanimoto metric | 0.7114 |
|---|---|
| Cosine metric | 0.8325 |
| Dice metric | 0.8314 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+201 more
