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DocumentationIdentifier: MM258009
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM258009 |
| SMILES |
CC(=O)OCCN(C)C=O
|
| InChIKey |
FQGWJOQNUDNGEC-UHFFFAOYSA-N
|
| MW [Da] |
145.16
Automatically obtained from RDkit software. |
| LogP |
-0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166176
Similarity: 0.75
Similarity to MM166176
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 131.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24519
Similarity: 0.6538
Similarity to MM24519
| Tanimoto metric | 0.6538 |
|---|---|
| Cosine metric | 0.7909 |
| Dice metric | 0.7907 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235769
Similarity: 0.6509
Similarity to MM235769
| Tanimoto metric | 0.6509 |
|---|---|
| Cosine metric | 0.7886 |
| Dice metric | 0.7886 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+18 more
