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DocumentationIdentifier: MM162590
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM162590 |
| SMILES |
C=C(C)C(=C)CCCN
|
| InChIKey |
NOLINORGMIHWCG-UHFFFAOYSA-N
|
| MW [Da] |
125.22
Automatically obtained from RDkit software. |
| LogP |
1.86
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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MM351655
Similarity: 0.8933
Similarity to MM351655
| Tanimoto metric | 0.8933 |
|---|---|
| Cosine metric | 0.9452 |
| Dice metric | 0.9437 |
| MW: | 139.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM302611
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Similarity to MM302611
| Tanimoto metric | 0.7882 |
|---|---|
| Cosine metric | 0.8878 |
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| MW: | 139.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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