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DocumentationIdentifier: MM262685
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262685 |
| SMILES |
CCN=C(N)CC(C)C=O
|
| InChIKey |
GEGGCXFRNOTGLH-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM226986
Similarity: 0.7213
Similarity to MM226986
| Tanimoto metric | 0.7213 |
|---|---|
| Cosine metric | 0.8382 |
| Dice metric | 0.8381 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355897
Similarity: 0.7117
Similarity to MM355897
| Tanimoto metric | 0.7117 |
|---|---|
| Cosine metric | 0.8345 |
| Dice metric | 0.8316 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236812
Similarity: 0.6639
Similarity to MM236812
| Tanimoto metric | 0.6639 |
|---|---|
| Cosine metric | 0.7986 |
| Dice metric | 0.798 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
