Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM55576
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM55576 |
| SMILES |
COCC=C(CO)CO
|
| InChIKey |
WVEKMTSXCIQXKH-UHFFFAOYSA-N
|
| MW [Da] |
132.16
Automatically obtained from RDkit software. |
| LogP |
-0.46
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM114682
Similarity: 0.8545
Similarity to MM114682
| Tanimoto metric | 0.8545 |
|---|---|
| Cosine metric | 0.9244 |
| Dice metric | 0.9216 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM436177
Similarity: 0.8462
Similarity to MM436177
| Tanimoto metric | 0.8462 |
|---|---|
| Cosine metric | 0.9199 |
| Dice metric | 0.9167 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM178805
Similarity: 0.791
Similarity to MM178805
| Tanimoto metric | 0.791 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.8833 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+520 more
