Identifier: MM56518
2D Structure
3D Structure
Source:
General | |
Identifier | MM56518 |
SMILES |
N#CC=CCC#CC=O
|
InChIKey |
AWNSYCSZVPEYIS-UHFFFAOYSA-N
|
MW [Da] |
119.12
Automatically obtained from RDkit software. |
LogP |
0.66
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM289949
Similarity: 0.7895
Similarity to MM289949
Tanimoto metric | 0.7895 |
---|---|
Cosine metric | 0.8885 |
Dice metric | 0.8824 |
MW: | 133.15 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.05 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM39581
Similarity: 0.7667
Similarity to MM39581
Tanimoto metric | 0.7667 |
---|---|
Cosine metric | 0.8756 |
Dice metric | 0.8679 |
MW: | 105.14 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.48 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM126476
Similarity: 0.7667
Similarity to MM126476
Tanimoto metric | 0.7667 |
---|---|
Cosine metric | 0.8756 |
Dice metric | 0.8679 |
MW: | 108.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.15 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+306 more