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DocumentationIdentifier: MM368867
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM368867 |
| SMILES |
C#CC=CC#CC(=O)C=C
|
| InChIKey |
AAKFDJZOLMPMBV-UHFFFAOYSA-N
|
| MW [Da] |
130.15
Automatically obtained from RDkit software. |
| LogP |
0.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170832
Similarity: 0.9103
Similarity to MM170832
| Tanimoto metric | 0.9103 |
|---|---|
| Cosine metric | 0.9541 |
| Dice metric | 0.953 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM368810
Similarity: 0.8256
Similarity to MM368810
| Tanimoto metric | 0.8256 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9045 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM368846
Similarity: 0.8068
Similarity to MM368846
| Tanimoto metric | 0.8068 |
|---|---|
| Cosine metric | 0.8932 |
| Dice metric | 0.8931 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+308 more
