Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM429891
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM429891 |
| SMILES |
C=CC1(OCC=CF)CC1
|
| InChIKey |
ITLSLXQPANEQJG-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM203176
Similarity: 0.856
Similarity to MM203176
| Tanimoto metric | 0.856 |
|---|---|
| Cosine metric | 0.9252 |
| Dice metric | 0.9224 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM341582
Similarity: 0.7868
Similarity to MM341582
| Tanimoto metric | 0.7868 |
|---|---|
| Cosine metric | 0.881 |
| Dice metric | 0.8807 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM429886
Similarity: 0.7754
Similarity to MM429886
| Tanimoto metric | 0.7754 |
|---|---|
| Cosine metric | 0.8737 |
| Dice metric | 0.8735 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+170 more
