Identifier: MM297196
2D Structure
3D Structure
Source:
General | |
Identifier | MM297196 |
SMILES |
CC(C)C(O)C(=O)CCO
|
InChIKey |
FYIDBRPVVLKDES-UHFFFAOYSA-N
|
MW [Da] |
146.19
Automatically obtained from RDkit software. |
LogP |
-0.05
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
3-hydroxy-2-methylheptan-4-one
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Similarity to 3-hydroxy-2-methylheptan-4-one
Tanimoto metric | 0.7667 |
---|---|
Cosine metric | 0.8685 |
Dice metric | 0.8679 |
MW: | 144.21 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.37 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM350985
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Similarity to MM350985
Tanimoto metric | 0.6667 |
---|---|
Cosine metric | 0.8016 |
Dice metric | 0.8 |
MW: | 146.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.05 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM133822
Similarity: 0.6102
Similarity to MM133822
Tanimoto metric | 0.6102 |
---|---|
Cosine metric | 0.7675 |
Dice metric | 0.7579 |
MW: | 130.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 0.98 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+315 more