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DocumentationIdentifier: MM233102
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233102 |
| SMILES |
CC(CO)C(F)(F)CCO
|
| InChIKey |
WPEBBDAEPZHAJV-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
0.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132581
Similarity: 0.7732
Similarity to MM132581
| Tanimoto metric | 0.7732 |
|---|---|
| Cosine metric | 0.8793 |
| Dice metric | 0.8721 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM102550
Similarity: 0.6804
Similarity to MM102550
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.8249 |
| Dice metric | 0.8098 |
| MW: | 124.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159960
Similarity: 0.6214
Similarity to MM159960
| Tanimoto metric | 0.6214 |
|---|---|
| Cosine metric | 0.7767 |
| Dice metric | 0.7665 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+319 more
