Identifier: MM327924
2D Structure
3D Structure
Source:
General | |
Identifier | MM327924 |
SMILES |
C=CC(C=C)CC(C)C=O
|
InChIKey |
SXFDJWDMLXHPCL-UHFFFAOYSA-N
|
MW [Da] |
138.21
Automatically obtained from RDkit software. |
LogP |
2.2
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM141810
Similarity: 0.8806
Similarity to MM141810
Tanimoto metric | 0.8806 |
---|---|
Cosine metric | 0.9384 |
Dice metric | 0.9365 |
MW: | 126.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.03 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM54383
Similarity: 0.806
Similarity to MM54383
Tanimoto metric | 0.806 |
---|---|
Cosine metric | 0.8978 |
Dice metric | 0.8926 |
MW: | 124.18 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.95 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM15444
Similarity: 0.7867
Similarity to MM15444
Tanimoto metric | 0.7867 |
---|---|
Cosine metric | 0.8806 |
Dice metric | 0.8806 |
MW: | 140.18 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.21 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+463 more