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DocumentationIdentifier: MM350497
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350497 |
| SMILES |
C=CC(=C)C(O)C(=C)CF
|
| InChIKey |
RCMMBBWKSMYXMF-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
1.62
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM350046
Similarity: 0.6918
Similarity to MM350046
| Tanimoto metric | 0.6918 |
|---|---|
| Cosine metric | 0.8252 |
| Dice metric | 0.8178 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161061
Similarity: 0.5749
Similarity to MM161061
| Tanimoto metric | 0.5749 |
|---|---|
| Cosine metric | 0.7316 |
| Dice metric | 0.73 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111899
Similarity: 0.5429
Similarity to MM111899
| Tanimoto metric | 0.5429 |
|---|---|
| Cosine metric | 0.7368 |
| Dice metric | 0.7037 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+42 more
