Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM365545
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM365545 |
| SMILES |
C=CC(=O)CCOCCO
|
| InChIKey |
ZSOKDECQTGEEAG-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166843
Similarity: 0.869
Similarity to MM166843
| Tanimoto metric | 0.869 |
|---|---|
| Cosine metric | 0.9322 |
| Dice metric | 0.9299 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365543
Similarity: 0.8295
Similarity to MM365543
| Tanimoto metric | 0.8295 |
|---|---|
| Cosine metric | 0.9077 |
| Dice metric | 0.9068 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365919
Similarity: 0.73
Similarity to MM365919
| Tanimoto metric | 0.73 |
|---|---|
| Cosine metric | 0.8443 |
| Dice metric | 0.8439 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+287 more
