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DocumentationIdentifier: MM281938
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281938 |
| SMILES |
C=CCC(=O)C=CCC=O
|
| InChIKey |
SQHMIIAFVMTNLF-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM281856
Similarity: 0.8784
Similarity to MM281856
| Tanimoto metric | 0.8784 |
|---|---|
| Cosine metric | 0.9353 |
| Dice metric | 0.9353 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM259393
Similarity: 0.8649
Similarity to MM259393
| Tanimoto metric | 0.8649 |
|---|---|
| Cosine metric | 0.9276 |
| Dice metric | 0.9275 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM280672
Similarity: 0.8514
Similarity to MM280672
| Tanimoto metric | 0.8514 |
|---|---|
| Cosine metric | 0.9199 |
| Dice metric | 0.9197 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+456 more
