Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM406292
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406292 |
| SMILES |
N#CC(CF)OC=CCO
|
| InChIKey |
WJWPDDPBTJKYTN-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
0.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199541
Similarity: 0.8687
Similarity to MM199541
| Tanimoto metric | 0.8687 |
|---|---|
| Cosine metric | 0.932 |
| Dice metric | 0.9297 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM116094
Similarity: 0.6869
Similarity to MM116094
| Tanimoto metric | 0.6869 |
|---|---|
| Cosine metric | 0.8288 |
| Dice metric | 0.8144 |
| MW: | 115.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM48989
Similarity: 0.6768
Similarity to MM48989
| Tanimoto metric | 0.6768 |
|---|---|
| Cosine metric | 0.8227 |
| Dice metric | 0.8072 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+389 more
