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DocumentationIdentifier: MM316345
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316345 |
| SMILES |
C=CC(=O)C1C(C=O)N1C
|
| InChIKey |
DGZHSBIOBSVLNA-UHFFFAOYSA-N
|
| MW [Da] |
139.15
Automatically obtained from RDkit software. |
| LogP |
-0.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM212289
Similarity: 0.8543
Similarity to MM212289
| Tanimoto metric | 0.8543 |
|---|---|
| Cosine metric | 0.9243 |
| Dice metric | 0.9214 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM432661
Similarity: 0.7782
Similarity to MM432661
| Tanimoto metric | 0.7782 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.8752 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM433035
Similarity: 0.7267
Similarity to MM433035
| Tanimoto metric | 0.7267 |
|---|---|
| Cosine metric | 0.8419 |
| Dice metric | 0.8417 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+13 more
