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DocumentationIdentifier: MM269927
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM269927 |
| SMILES |
C=C(C)CC(=O)C(C)=CF
|
| InChIKey |
OMKKOWYTHDBYPE-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM247238
Similarity: 0.8538
Similarity to MM247238
| Tanimoto metric | 0.8538 |
|---|---|
| Cosine metric | 0.9214 |
| Dice metric | 0.9212 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174858
Similarity: 0.7724
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| Tanimoto metric | 0.7724 |
|---|---|
| Cosine metric | 0.8788 |
| Dice metric | 0.8716 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM416565
Similarity: 0.7183
Similarity to MM416565
| Tanimoto metric | 0.7183 |
|---|---|
| Cosine metric | 0.8361 |
| Dice metric | 0.8361 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+224 more
