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DocumentationIdentifier: MM243348
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243348 |
| SMILES |
CC=CC(C)(CO)NC=O
|
| InChIKey |
YVVIYIAGRUBPMN-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312872
Similarity: 0.6736
Similarity to MM312872
| Tanimoto metric | 0.6736 |
|---|---|
| Cosine metric | 0.807 |
| Dice metric | 0.805 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312627
Similarity: 0.6599
Similarity to MM312627
| Tanimoto metric | 0.6599 |
|---|---|
| Cosine metric | 0.7964 |
| Dice metric | 0.7951 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM299831
Similarity: 0.6202
Similarity to MM299831
| Tanimoto metric | 0.6202 |
|---|---|
| Cosine metric | 0.7875 |
| Dice metric | 0.7656 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+103 more
