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DocumentationIdentifier: MM336168
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM336168 |
| SMILES |
CCC1(C#N)NC1C(C)C
|
| InChIKey |
WKPYAZQGSKGZAM-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM276390
Similarity: 0.7667
Similarity to MM276390
| Tanimoto metric | 0.7667 |
|---|---|
| Cosine metric | 0.8679 |
| Dice metric | 0.8679 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328183
Similarity: 0.7637
Similarity to MM328183
| Tanimoto metric | 0.7637 |
|---|---|
| Cosine metric | 0.8661 |
| Dice metric | 0.866 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM431917
Similarity: 0.7573
Similarity to MM431917
| Tanimoto metric | 0.7573 |
|---|---|
| Cosine metric | 0.8619 |
| Dice metric | 0.8619 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+179 more
