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DocumentationIdentifier: MM276390
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM276390 |
| SMILES |
CC(C)CC1(C#N)NC1C
|
| InChIKey |
HHEGAMQDNAVLPS-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
MM336168
Similarity: 0.7667
Similarity to MM336168
| 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
|
MM293185
Similarity: 0.7171
Similarity to MM293185
| Tanimoto metric | 0.7171 |
|---|---|
| Cosine metric | 0.8354 |
| Dice metric | 0.8353 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM431300
Similarity: 0.7131
Similarity to MM431300
| Tanimoto metric | 0.7131 |
|---|---|
| Cosine metric | 0.8326 |
| Dice metric | 0.8325 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+161 more
