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DocumentationIdentifier: MM355397
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355397 |
| SMILES |
CCNCC(C)OCCO
|
| InChIKey |
DEGGTFUTODIJKZ-UHFFFAOYSA-N
|
| MW [Da] |
147.22
Automatically obtained from RDkit software. |
| LogP |
-0.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM74672
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Similarity to MM74672
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291186
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Similarity to MM291186
| Tanimoto metric | 0.764 |
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| Cosine metric | 0.8667 |
| Dice metric | 0.8662 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.41 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM291187
Similarity: 0.764
Similarity to MM291187
| Tanimoto metric | 0.764 |
|---|---|
| Cosine metric | 0.8667 |
| Dice metric | 0.8662 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+435 more
