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DocumentationIdentifier: MM329783
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM329783 |
| SMILES |
C=CC(=O)OC(C=C)CN
|
| InChIKey |
CVRFKCUPKWQVRY-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM329447
Similarity: 0.7852
Similarity to MM329447
| Tanimoto metric | 0.7852 |
|---|---|
| Cosine metric | 0.8797 |
| Dice metric | 0.8797 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142160
Similarity: 0.7583
Similarity to MM142160
| Tanimoto metric | 0.7583 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8626 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329017
Similarity: 0.7
Similarity to MM329017
| Tanimoto metric | 0.7 |
|---|---|
| Cosine metric | 0.8266 |
| Dice metric | 0.8235 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+246 more
