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DocumentationIdentifier: MM272142
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272142 |
| SMILES |
C=CC(CN(C)C)OC=O
|
| InChIKey |
KMUYWDBRXPHUSC-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM65591
Similarity: 0.8273
Similarity to MM65591
| Tanimoto metric | 0.8273 |
|---|---|
| Cosine metric | 0.9095 |
| Dice metric | 0.9055 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM65598
Similarity: 0.6149
Similarity to MM65598
| Tanimoto metric | 0.6149 |
|---|---|
| Cosine metric | 0.7639 |
| Dice metric | 0.7615 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68677
Similarity: 0.6107
Similarity to MM68677
| Tanimoto metric | 0.6107 |
|---|---|
| Cosine metric | 0.761 |
| Dice metric | 0.7583 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+111 more
