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DocumentationIdentifier: MM291217
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291217 |
| SMILES |
CCCN(C)CCOCC
|
| InChIKey |
WINMMVFOPLDHOL-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM155722
Similarity: 0.8649
Similarity to MM155722
| Tanimoto metric | 0.8649 |
|---|---|
| Cosine metric | 0.93 |
| Dice metric | 0.9275 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM165657
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| Tanimoto metric | 0.7568 |
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| Cosine metric | 0.8699 |
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||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM291336
Similarity: 0.7273
Similarity to MM291336
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8424 |
| Dice metric | 0.8421 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+450 more
