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DocumentationIdentifier: MM162130
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM162130 |
| SMILES |
C=C(C)C(N)CCCC
|
| InChIKey |
PDSZTPXECILRHJ-UHFFFAOYSA-N
|
| MW [Da] |
127.23
Automatically obtained from RDkit software. |
| LogP |
2.08
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 | 0.881 |
|---|---|
| Cosine metric | 0.9386 |
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||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+681 more
