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DocumentationIdentifier: MM447130
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447130 |
| SMILES |
CCNCCN1CC1CC
|
| InChIKey |
ANDPWVFCHAGCBY-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM447186
Similarity: 0.8361
Similarity to MM447186
| Tanimoto metric | 0.8361 |
|---|---|
| Cosine metric | 0.912 |
| Dice metric | 0.9107 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM127619
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Similarity to MM127619
| Tanimoto metric | 0.8302 |
|---|---|
| Cosine metric | 0.9111 |
| Dice metric | 0.9072 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.04 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM212435
Similarity: 0.7368
Similarity to MM212435
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.8506 |
| Dice metric | 0.8485 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+343 more
