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DocumentationIdentifier: MM380755
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM380755 |
| SMILES |
C=CC1(CC)NC1C(C)=O
|
| InChIKey |
YWINBUAIVSOFER-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM382282
Similarity: 0.7698
Similarity to MM382282
| Tanimoto metric | 0.7698 |
|---|---|
| Cosine metric | 0.8774 |
| Dice metric | 0.8699 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM422039
Similarity: 0.7143
Similarity to MM422039
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8337 |
| Dice metric | 0.8333 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM385984
Similarity: 0.7086
Similarity to MM385984
| Tanimoto metric | 0.7086 |
|---|---|
| Cosine metric | 0.832 |
| Dice metric | 0.8295 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+32 more
