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DocumentationIdentifier: MM202865
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM202865 |
| SMILES |
CCC1(CCCN)CN1
|
| InChIKey |
GYSAKSVZUZRMDG-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM425627
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| Tanimoto metric | 0.9055 |
|---|---|
| Cosine metric | 0.9516 |
| Dice metric | 0.9504 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.72 |
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Total active interactions
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MM343628
Similarity: 0.8042
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| Tanimoto metric | 0.8042 |
|---|---|
| Cosine metric | 0.8968 |
| Dice metric | 0.8915 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+268 more
