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DocumentationIdentifier: MM265926
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265926 |
| SMILES |
CCC(=O)OC(C)=CCF
|
| InChIKey |
QUIMTUKQSQQMNX-UHFFFAOYSA-N
|
| MW [Da] |
146.16
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
MM136076
Similarity: 0.7638
Similarity to MM136076
| Tanimoto metric | 0.7638 |
|---|---|
| Cosine metric | 0.8739 |
| Dice metric | 0.8661 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265115
Similarity: 0.7211
Similarity to MM265115
| Tanimoto metric | 0.7211 |
|---|---|
| Cosine metric | 0.838 |
| Dice metric | 0.8379 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265924
Similarity: 0.6849
Similarity to MM265924
| Tanimoto metric | 0.6849 |
|---|---|
| Cosine metric | 0.8134 |
| Dice metric | 0.813 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+390 more
