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DocumentationIdentifier: MM300867
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM300867 |
| SMILES |
CC(C)C(N)CCCCN
|
| InChIKey |
MJGBGTHGUZRICU-UHFFFAOYSA-N
|
| MW [Da] |
144.26
Automatically obtained from RDkit software. |
| LogP |
1.1
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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MM161927
Similarity: 0.871
Similarity to MM161927
| Tanimoto metric | 0.871 |
|---|---|
| Cosine metric | 0.9333 |
| Dice metric | 0.931 |
| MW: | 129.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300865
Similarity: 0.8485
Similarity to MM300865
| Tanimoto metric | 0.8485 |
|---|---|
| Cosine metric | 0.9182 |
| Dice metric | 0.918 |
| MW: | 143.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.55 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM254470
Similarity: 0.8182
Similarity to MM254470
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9005 |
| Dice metric | 0.9 |
| MW: | 143.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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