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DocumentationIdentifier: MM254353
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254353 |
| SMILES |
C=C(C)C(=O)C(C)=C(C)C
|
| InChIKey |
KTMQHJHUJKBYFF-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161490
Similarity: 0.7869
Similarity to MM161490
| Tanimoto metric | 0.7869 |
|---|---|
| Cosine metric | 0.8871 |
| Dice metric | 0.8807 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM301158
Similarity: 0.7538
Similarity to MM301158
| Tanimoto metric | 0.7538 |
|---|---|
| Cosine metric | 0.8618 |
| Dice metric | 0.8596 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354954
Similarity: 0.6835
Similarity to MM354954
| Tanimoto metric | 0.6835 |
|---|---|
| Cosine metric | 0.8127 |
| Dice metric | 0.812 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+259 more
