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DocumentationIdentifier: MM263132
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263132 |
| SMILES |
C=C(CNC)NC(=O)CC
|
| InChIKey |
SBJSLMPMXGSMED-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135532
Similarity: 0.75
Similarity to MM135532
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM37905
Similarity: 0.7063
Similarity to MM37905
| Tanimoto metric | 0.7063 |
|---|---|
| Cosine metric | 0.828 |
| Dice metric | 0.8279 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263537
Similarity: 0.7034
Similarity to MM263537
| Tanimoto metric | 0.7034 |
|---|---|
| Cosine metric | 0.8262 |
| Dice metric | 0.8259 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+482 more
