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DocumentationIdentifier: MM456859
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM456859 |
| SMILES |
C=CC(C=C)=COC1CC1
|
| InChIKey |
QFHINCFBSGJXAV-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM209711
Similarity: 0.913
Similarity to MM209711
| Tanimoto metric | 0.913 |
|---|---|
| Cosine metric | 0.9555 |
| Dice metric | 0.9545 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM435902
Similarity: 0.7636
Similarity to MM435902
| Tanimoto metric | 0.7636 |
|---|---|
| Cosine metric | 0.8671 |
| Dice metric | 0.866 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM456755
Similarity: 0.7304
Similarity to MM456755
| Tanimoto metric | 0.7304 |
|---|---|
| Cosine metric | 0.8466 |
| Dice metric | 0.8442 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+121 more
