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DocumentationIdentifier: MM447532
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447532 |
| SMILES |
CCN1CC1CC=CCN
|
| InChIKey |
JPKODPRKLGFBLJ-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM440687
Similarity: 0.7806
Similarity to MM440687
| Tanimoto metric | 0.7806 |
|---|---|
| Cosine metric | 0.8776 |
| Dice metric | 0.8768 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM420120
Similarity: 0.7647
Similarity to MM420120
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.871 |
| Dice metric | 0.8667 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM194721
Similarity: 0.6323
Similarity to MM194721
| Tanimoto metric | 0.6323 |
|---|---|
| Cosine metric | 0.7754 |
| Dice metric | 0.7747 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+115 more
