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DocumentationIdentifier: MM272288
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272288 |
| SMILES |
COCC(CN)OC(C)=O
|
| InChIKey |
OVXQATZHCBRLEO-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
-0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149959
Similarity: 0.8051
Similarity to MM149959
| Tanimoto metric | 0.8051 |
|---|---|
| Cosine metric | 0.8973 |
| Dice metric | 0.892 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328775
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| Tanimoto metric | 0.6934 |
|---|---|
| Cosine metric | 0.8191 |
| Dice metric | 0.819 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM328777
Similarity: 0.6835
Similarity to MM328777
| Tanimoto metric | 0.6835 |
|---|---|
| Cosine metric | 0.812 |
| Dice metric | 0.812 |
| MW: | 149.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+127 more
