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DocumentationIdentifier: MM459337
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM459337 |
| SMILES |
C=CCNCCOC1CC1
|
| InChIKey |
OVQXEAWHVJYCKT-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
0.94
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM447047
Similarity: 0.7683
Similarity to MM447047
| Tanimoto metric | 0.7683 |
|---|---|
| Cosine metric | 0.8765 |
| Dice metric | 0.869 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM212957
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| Tanimoto metric | 0.6341 |
|---|---|
| Cosine metric | 0.7963 |
| Dice metric | 0.7761 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM193862
Similarity: 0.6132
Similarity to MM193862
| Tanimoto metric | 0.6132 |
|---|---|
| Cosine metric | 0.7609 |
| Dice metric | 0.7602 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+370 more
