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DocumentationIdentifier: MM195584
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM195584 |
| SMILES |
CN1CC1CC=CC=O
|
| InChIKey |
ADZCXENUKSTOHM-UHFFFAOYSA-N
|
| MW [Da] |
125.17
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM383095
Similarity: 0.8374
Similarity to MM383095
| Tanimoto metric | 0.8374 |
|---|---|
| Cosine metric | 0.9115 |
| Dice metric | 0.9115 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM420120
Similarity: 0.7402
Similarity to MM420120
| Tanimoto metric | 0.7402 |
|---|---|
| Cosine metric | 0.8509 |
| Dice metric | 0.8507 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM195585
Similarity: 0.7045
Similarity to MM195585
| Tanimoto metric | 0.7045 |
|---|---|
| Cosine metric | 0.8267 |
| Dice metric | 0.8267 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+111 more
