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DocumentationIdentifier: MM244072
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244072 |
| SMILES |
CC(=O)C(C)(C=O)NC=O
|
| InChIKey |
USFBYKPVBKYPNM-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM40527
Similarity: 0.7368
Similarity to MM40527
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8584 |
| Dice metric | 0.8485 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM34468
Similarity: 0.5263
Similarity to MM34468
| Tanimoto metric | 0.5263 |
|---|---|
| Cosine metric | 0.7255 |
| Dice metric | 0.6897 |
| MW: | 115.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM42385
Similarity: 0.5263
Similarity to MM42385
| Tanimoto metric | 0.5263 |
|---|---|
| Cosine metric | 0.7255 |
| Dice metric | 0.6897 |
| MW: | 129.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+23 more
