Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM48525
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM48525 |
| SMILES |
N#CC(F)CCOC=O
|
| InChIKey |
URDYXNQJCSUCCS-UHFFFAOYSA-N
|
| MW [Da] |
131.11
Automatically obtained from RDkit software. |
| LogP |
0.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM239745
Similarity: 0.7358
Similarity to MM239745
| Tanimoto metric | 0.7358 |
|---|---|
| Cosine metric | 0.8578 |
| Dice metric | 0.8478 |
| MW: | 149.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM105552
Similarity: 0.6923
Similarity to MM105552
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8321 |
| Dice metric | 0.8182 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165954
Similarity: 0.6854
Similarity to MM165954
| Tanimoto metric | 0.6854 |
|---|---|
| Cosine metric | 0.814 |
| Dice metric | 0.8133 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+175 more
