Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM79886
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM79886 |
| SMILES |
C#CC(C=O)OC(C)C=O
|
| InChIKey |
YLSSZKQNPYBDBQ-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
-0.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199379
Similarity: 0.9136
Similarity to MM199379
| Tanimoto metric | 0.9136 |
|---|---|
| Cosine metric | 0.9558 |
| Dice metric | 0.9548 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328276
Similarity: 0.9059
Similarity to MM328276
| Tanimoto metric | 0.9059 |
|---|---|
| Cosine metric | 0.9506 |
| Dice metric | 0.9506 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141891
Similarity: 0.8519
Similarity to MM141891
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+421 more
