Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM382645
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM382645 |
| SMILES |
C#CC=C(C=O)OCC=C
|
| InChIKey |
ZHEZIRDDVUXYJR-UHFFFAOYSA-N
|
| MW [Da] |
136.15
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM179190
Similarity: 0.8165
Similarity to MM179190
| Tanimoto metric | 0.8165 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.899 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM200189
Similarity: 0.7706
Similarity to MM200189
| Tanimoto metric | 0.7706 |
|---|---|
| Cosine metric | 0.8779 |
| Dice metric | 0.8705 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM382655
Similarity: 0.7236
Similarity to MM382655
| Tanimoto metric | 0.7236 |
|---|---|
| Cosine metric | 0.84 |
| Dice metric | 0.8396 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+127 more
