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DocumentationIdentifier: MM325695
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325695 |
| SMILES |
CCC(F)CC(CC)CC
|
| InChIKey |
IAMCMAZQJYFOSE-UHFFFAOYSA-N
|
| MW [Da] |
146.25
Automatically obtained from RDkit software. |
| LogP |
3.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141513
Similarity: 0.9063
Similarity to MM141513
| Tanimoto metric | 0.9063 |
|---|---|
| Cosine metric | 0.952 |
| Dice metric | 0.9508 |
| MW: | 132.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM149672
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| Tanimoto metric | 0.8125 |
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| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 132.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM261138
Similarity: 0.7867
Similarity to MM261138
| Tanimoto metric | 0.7867 |
|---|---|
| Cosine metric | 0.8815 |
| Dice metric | 0.8806 |
| MW: | 150.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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