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DocumentationIdentifier: MM232272
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM232272 |
| SMILES |
CC(C)(N)CCCCCF
|
| InChIKey |
FIWCRTGSUBYIQK-UHFFFAOYSA-N
|
| MW [Da] |
147.24
Automatically obtained from RDkit software. |
| LogP |
2.25
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 | 0.7808 |
|---|---|
| Cosine metric | 0.8779 |
| Dice metric | 0.8769 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM131438
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| Cosine metric | 0.8745 |
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|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
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| LogP: | 2.3 |
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Total active interactions
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MM152461
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| Tanimoto metric | 0.7353 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
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+582 more
