Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM264425
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264425 |
| SMILES |
C=C(CC)CC(=O)C=CN
|
| InChIKey |
STNMYFBXTRVLMX-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41288
Similarity: 0.8019
Similarity to MM41288
| Tanimoto metric | 0.8019 |
|---|---|
| Cosine metric | 0.8955 |
| Dice metric | 0.8901 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142683
Similarity: 0.7547
Similarity to MM142683
| Tanimoto metric | 0.7547 |
|---|---|
| Cosine metric | 0.8687 |
| Dice metric | 0.8602 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264543
Similarity: 0.7258
Similarity to MM264543
| Tanimoto metric | 0.7258 |
|---|---|
| Cosine metric | 0.8412 |
| Dice metric | 0.8411 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+107 more
