Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM296037
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM296037 |
| SMILES |
CC(=CCO)C(O)CC=O
|
| InChIKey |
WLHKNQKTRBYPMA-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175067
Similarity: 0.7479
Similarity to MM175067
| Tanimoto metric | 0.7479 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8558 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72313
Similarity: 0.6875
Similarity to MM72313
| Tanimoto metric | 0.6875 |
|---|---|
| Cosine metric | 0.815 |
| Dice metric | 0.8148 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72335
Similarity: 0.5973
Similarity to MM72335
| Tanimoto metric | 0.5973 |
|---|---|
| Cosine metric | 0.7479 |
| Dice metric | 0.7479 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+475 more
