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DocumentationIdentifier: MM363731
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363731 |
| SMILES |
CN(C=O)CCCCCN
|
| InChIKey |
GDHAIAGFHNTGCJ-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.2
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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| Tanimoto metric | 0.9375 |
|---|---|
| Cosine metric | 0.9682 |
| Dice metric | 0.9677 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 1.26 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 3
Total passive interactions
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| LogP: | 1.51 |
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 0.87 |
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Total active interactions
|
+520 more
