Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM42259
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM42259 |
| SMILES |
N#CCC(F)(C=O)CO
|
| InChIKey |
PPJLXDFYMKKJHW-UHFFFAOYSA-N
|
| MW [Da] |
131.11
Automatically obtained from RDkit software. |
| LogP |
-0.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM61467
Similarity: 0.7584
Similarity to MM61467
| Tanimoto metric | 0.7584 |
|---|---|
| Cosine metric | 0.8709 |
| Dice metric | 0.8626 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35127
Similarity: 0.6991
Similarity to MM35127
| Tanimoto metric | 0.6991 |
|---|---|
| Cosine metric | 0.8361 |
| Dice metric | 0.8229 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM61751
Similarity: 0.6933
Similarity to MM61751
| Tanimoto metric | 0.6933 |
|---|---|
| Cosine metric | 0.8326 |
| Dice metric | 0.8188 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+137 more
