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DocumentationIdentifier: MM355469
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355469 |
| SMILES |
O=CC(O)C(F)C=CCO
|
| InChIKey |
KKLZDGSPSYBBIJ-UHFFFAOYSA-N
|
| MW [Da] |
148.13
Automatically obtained from RDkit software. |
| LogP |
-0.57
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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MM48191
Similarity: 0.7188
Similarity to MM48191
| Tanimoto metric | 0.7188 |
|---|---|
| Cosine metric | 0.8478 |
| Dice metric | 0.8364 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35439
Similarity: 0.6719
Similarity to MM35439
| Tanimoto metric | 0.6719 |
|---|---|
| Cosine metric | 0.8197 |
| Dice metric | 0.8037 |
| MW: | 118.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM270024
Similarity: 0.6706
Similarity to MM270024
| Tanimoto metric | 0.6706 |
|---|---|
| Cosine metric | 0.8067 |
| Dice metric | 0.8028 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+125 more
