Identifier: MM163886
2D Structure
3D Structure
Source:
General | |
Identifier | MM163886 |
SMILES |
COCC=C(C)C(C)=O
|
InChIKey |
DSFHVRBEEYYLQV-UHFFFAOYSA-N
|
MW [Da] |
128.17
Automatically obtained from RDkit software. |
LogP |
1.17
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
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MM295050
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Similarity to MM295050
Tanimoto metric | 0.8824 |
---|---|
Cosine metric | 0.9393 |
Dice metric | 0.9375 |
MW: | 142.2 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.56 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM295157
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Similarity to MM295157
Tanimoto metric | 0.8571 |
---|---|
Cosine metric | 0.9258 |
Dice metric | 0.9231 |
MW: | 140.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.68 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM108859
Similarity: 0.7889
Similarity to MM108859
Tanimoto metric | 0.7889 |
---|---|
Cosine metric | 0.8882 |
Dice metric | 0.882 |
MW: | 114.14 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 0.51 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+587 more