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DocumentationIdentifier: MM277284
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM277284 |
| SMILES |
CC1C(C)N1C(C)(C)C=O
|
| InChIKey |
RTUNSHJYXFPLKP-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM152071
Similarity: 0.8467
Similarity to MM152071
| Tanimoto metric | 0.8467 |
|---|---|
| Cosine metric | 0.9202 |
| Dice metric | 0.917 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM421206
Similarity: 0.8175
Similarity to MM421206
| Tanimoto metric | 0.8175 |
|---|---|
| Cosine metric | 0.9042 |
| Dice metric | 0.8996 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM346000
Similarity: 0.7102
Similarity to MM346000
| Tanimoto metric | 0.7102 |
|---|---|
| Cosine metric | 0.8339 |
| Dice metric | 0.8306 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+184 more
