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DocumentationIdentifier: MM321871
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM321871 |
| SMILES |
C=CC(O)C=CC(=O)NC
|
| InChIKey |
DYNONNDPCKKADV-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
-0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263927
Similarity: 0.8333
Similarity to MM263927
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM252438
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| Tanimoto metric | 0.7131 |
|---|---|
| Cosine metric | 0.836 |
| Dice metric | 0.8325 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM305723
Similarity: 0.6491
Similarity to MM305723
| Tanimoto metric | 0.6491 |
|---|---|
| Cosine metric | 0.8057 |
| Dice metric | 0.7872 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+259 more
