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DocumentationIdentifier: MM350463
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350463 |
| SMILES |
C=C(C=O)C(C)C(=C)CC
|
| InChIKey |
XBBPLXSXIIFLBS-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM378542
Similarity: 0.7752
Similarity to MM378542
| Tanimoto metric | 0.7752 |
|---|---|
| Cosine metric | 0.874 |
| Dice metric | 0.8734 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254133
Similarity: 0.7687
Similarity to MM254133
| Tanimoto metric | 0.7687 |
|---|---|
| Cosine metric | 0.8724 |
| Dice metric | 0.8692 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160669
Similarity: 0.7395
Similarity to MM160669
| Tanimoto metric | 0.7395 |
|---|---|
| Cosine metric | 0.8599 |
| Dice metric | 0.8502 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+169 more
