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DocumentationIdentifier: MM420759
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM420759 |
| SMILES |
CC(C=O)N1CC1(C)C
|
| InChIKey |
ZZRZZGZDCJSLGG-UHFFFAOYSA-N
|
| MW [Da] |
127.19
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM314453
Similarity: 0.9308
Similarity to MM314453
| Tanimoto metric | 0.9308 |
|---|---|
| Cosine metric | 0.9648 |
| Dice metric | 0.9641 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM418721
Similarity: 0.7707
Similarity to MM418721
| Tanimoto metric | 0.7707 |
|---|---|
| Cosine metric | 0.8779 |
| Dice metric | 0.8705 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364559
Similarity: 0.7686
Similarity to MM364559
| Tanimoto metric | 0.7686 |
|---|---|
| Cosine metric | 0.8767 |
| Dice metric | 0.8692 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+195 more
