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DocumentationIdentifier: MM355600
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355600 |
| SMILES |
CC(C=CC=O)N(C)C=O
|
| InChIKey |
UVGNSCSNHMXZJW-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174068
Similarity: 0.8155
Similarity to MM174068
| Tanimoto metric | 0.8155 |
|---|---|
| Cosine metric | 0.9031 |
| Dice metric | 0.8984 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85760
Similarity: 0.672
Similarity to MM85760
| Tanimoto metric | 0.672 |
|---|---|
| Cosine metric | 0.8039 |
| Dice metric | 0.8038 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24631
Similarity: 0.6311
Similarity to MM24631
| Tanimoto metric | 0.6311 |
|---|---|
| Cosine metric | 0.7944 |
| Dice metric | 0.7738 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+259 more
