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DocumentationIdentifier: MM364486
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364486 |
| SMILES |
C=C(CN)CCNCCN
|
| InChIKey |
BBGWNAZRPRBQSM-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.56
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 | 0.8667 |
|---|---|
| Cosine metric | 0.9309 |
| Dice metric | 0.9286 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| PI: | 1
Total passive interactions
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| LogP: | 0.89 |
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|---|---|---|---|---|---|
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Total passive interactions
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| LogP: | 0.5 |
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+746 more
