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DocumentationIdentifier: MM316696
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316696 |
| SMILES |
CC(C)C(NC=O)C(C)C
|
| InChIKey |
JDWVICHVPTYXQY-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM314166
Similarity: 0.75
Similarity to MM314166
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM317443
Similarity: 0.7312
Similarity to MM317443
| Tanimoto metric | 0.7312 |
|---|---|
| Cosine metric | 0.8495 |
| Dice metric | 0.8447 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72480
Similarity: 0.7158
Similarity to MM72480
| Tanimoto metric | 0.7158 |
|---|---|
| Cosine metric | 0.8401 |
| Dice metric | 0.8344 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+445 more
