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DocumentationIdentifier: MM125501
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM125501 |
| SMILES |
CNCCCCCF
|
| InChIKey |
QSAYEQRECDBDHM-UHFFFAOYSA-N
|
| MW [Da] |
119.18
Automatically obtained from RDkit software. |
| LogP |
1.35
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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MM446768
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| Tanimoto metric | 0.84 |
|---|---|
| Cosine metric | 0.9165 |
| Dice metric | 0.913 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 1.74 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.69 |
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+974 more
