Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM74157
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM74157 |
| SMILES |
CC(=O)C(C)=CNCC#N
|
| InChIKey |
DFBSGKJMTUWAHE-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM48413
Similarity: 0.8364
Similarity to MM48413
| Tanimoto metric | 0.8364 |
|---|---|
| Cosine metric | 0.9145 |
| Dice metric | 0.9109 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM438632
Similarity: 0.7797
Similarity to MM438632
| Tanimoto metric | 0.7797 |
|---|---|
| Cosine metric | 0.8772 |
| Dice metric | 0.8762 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295058
Similarity: 0.7731
Similarity to MM295058
| Tanimoto metric | 0.7731 |
|---|---|
| Cosine metric | 0.8728 |
| Dice metric | 0.872 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+352 more
