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DocumentationIdentifier: MM442853
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM442853 |
| SMILES |
CCN1CC1C(C)CC#N
|
| InChIKey |
ARPHMQNFEMCBSJ-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM434261
Similarity: 0.7202
Similarity to MM434261
| Tanimoto metric | 0.7202 |
|---|---|
| Cosine metric | 0.8376 |
| Dice metric | 0.8373 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM446473
Similarity: 0.7196
Similarity to MM446473
| Tanimoto metric | 0.7196 |
|---|---|
| Cosine metric | 0.8394 |
| Dice metric | 0.837 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM367820
Similarity: 0.6853
Similarity to MM367820
| Tanimoto metric | 0.6853 |
|---|---|
| Cosine metric | 0.8135 |
| Dice metric | 0.8133 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+161 more
