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DocumentationIdentifier: MM244598
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244598 |
| SMILES |
CC(CC(O)CF)C(F)F
|
| InChIKey |
HZXCIUNLEPQZSW-UHFFFAOYSA-N
|
| MW [Da] |
156.15
Automatically obtained from RDkit software. |
| LogP |
1.61
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 | 0.8105 |
|---|---|
| Cosine metric | 0.9003 |
| Dice metric | 0.8953 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.7117 |
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| Cosine metric | 0.8316 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.75 |
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|---|---|---|---|---|---|
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Total active interactions
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MM274930
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Similarity to MM274930
| Tanimoto metric | 0.6937 |
|---|---|
| Cosine metric | 0.8192 |
| Dice metric | 0.8191 |
| MW: | 156.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+460 more
