Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM377860
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM377860 |
| SMILES |
C=C(C=O)C(CC#N)OC
|
| InChIKey |
FCJISMXTGSMNDK-UHFFFAOYSA-N
|
| MW [Da] |
139.15
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172765
Similarity: 0.7413
Similarity to MM172765
| Tanimoto metric | 0.7413 |
|---|---|
| Cosine metric | 0.861 |
| Dice metric | 0.8514 |
| MW: | 125.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298564
Similarity: 0.5691
Similarity to MM298564
| Tanimoto metric | 0.5691 |
|---|---|
| Cosine metric | 0.7258 |
| Dice metric | 0.7254 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM94445
Similarity: 0.5587
Similarity to MM94445
| Tanimoto metric | 0.5587 |
|---|---|
| Cosine metric | 0.7171 |
| Dice metric | 0.7168 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+159 more
