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DocumentationIdentifier: MM351176
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351176 |
| SMILES |
C=CC(O)C(=O)C(F)CC
|
| InChIKey |
XXGYHMUDYWHNRZ-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM47505
Similarity: 0.7711
Similarity to MM47505
| Tanimoto metric | 0.7711 |
|---|---|
| Cosine metric | 0.8781 |
| Dice metric | 0.8707 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351699
Similarity: 0.6056
Similarity to MM351699
| Tanimoto metric | 0.6056 |
|---|---|
| Cosine metric | 0.7547 |
| Dice metric | 0.7544 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM351536
Similarity: 0.5981
Similarity to MM351536
| Tanimoto metric | 0.5981 |
|---|---|
| Cosine metric | 0.7489 |
| Dice metric | 0.7485 |
| MW: | 143.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+83 more
