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DocumentationIdentifier: MM291186
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291186 |
| SMILES |
CCCNCC(C)OCC
|
| InChIKey |
QAVGKDWUKBNWEA-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291187
Similarity: 0.8537
Similarity to MM291187
| Tanimoto metric | 0.8537 |
|---|---|
| Cosine metric | 0.9211 |
| Dice metric | 0.9211 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165571
Similarity: 0.8289
Similarity to MM165571
| Tanimoto metric | 0.8289 |
|---|---|
| Cosine metric | 0.9105 |
| Dice metric | 0.9065 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM81769
Similarity: 0.8095
Similarity to MM81769
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8947 |
| Dice metric | 0.8947 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+454 more
