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DocumentationIdentifier: MM266811
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM266811 |
| SMILES |
C=CCC(=O)C=C(C)C=C
|
| InChIKey |
JZNHYCYDGXEUBS-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143726
Similarity: 0.8804
Similarity to MM143726
| Tanimoto metric | 0.8804 |
|---|---|
| Cosine metric | 0.9383 |
| Dice metric | 0.9364 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM339115
Similarity: 0.7941
Similarity to MM339115
| Tanimoto metric | 0.7941 |
|---|---|
| Cosine metric | 0.8853 |
| Dice metric | 0.8852 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM267990
Similarity: 0.7431
Similarity to MM267990
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8531 |
| Dice metric | 0.8526 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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