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DocumentationIdentifier: MM156024
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM156024 |
| SMILES |
C#CCC(F)CCCC
|
| InChIKey |
FYPPKOQPVZAWFU-UHFFFAOYSA-N
|
| MW [Da] |
128.19
Automatically obtained from RDkit software. |
| LogP |
2.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291645
Similarity: 0.9206
Similarity to MM291645
| Tanimoto metric | 0.9206 |
|---|---|
| Cosine metric | 0.9595 |
| Dice metric | 0.9587 |
| MW: | 142.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291646
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| Tanimoto metric | 0.8788 |
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| Cosine metric | 0.9374 |
| Dice metric | 0.9355 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM107249
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| Tanimoto metric | 0.8276 |
|---|---|
| Cosine metric | 0.9097 |
| Dice metric | 0.9057 |
| MW: | 114.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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