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DocumentationIdentifier: MM376715
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376715 |
| SMILES |
C=CC(CCN)N(C)C=O
|
| InChIKey |
HAKWEAFQECTRNR-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
-0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM349570
Similarity: 0.6732
Similarity to MM349570
| Tanimoto metric | 0.6732 |
|---|---|
| Cosine metric | 0.8067 |
| Dice metric | 0.8047 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376864
Similarity: 0.6667
Similarity to MM376864
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8001 |
| Dice metric | 0.8 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388245
Similarity: 0.6549
Similarity to MM388245
| Tanimoto metric | 0.6549 |
|---|---|
| Cosine metric | 0.7916 |
| Dice metric | 0.7915 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+97 more
