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DocumentationIdentifier: MM264455
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264455 |
| SMILES |
C=C(CN)NC(=O)C=CC
|
| InChIKey |
JSWBECUEAPLHTN-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM48046
Similarity: 0.7463
Similarity to MM48046
| Tanimoto metric | 0.7463 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.8547 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333839
Similarity: 0.7047
Similarity to MM333839
| Tanimoto metric | 0.7047 |
|---|---|
| Cosine metric | 0.828 |
| Dice metric | 0.8268 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264560
Similarity: 0.6571
Similarity to MM264560
| Tanimoto metric | 0.6571 |
|---|---|
| Cosine metric | 0.7936 |
| Dice metric | 0.7931 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+254 more
