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DocumentationIdentifier: MM220607
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM220607 |
| SMILES |
CCC(C)(F)CC(F)(F)F
|
| InChIKey |
IBYCPUBEVSKXIA-UHFFFAOYSA-N
|
| MW [Da] |
158.14
Automatically obtained from RDkit software. |
| LogP |
3.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130615
Similarity: 0.8235
Similarity to MM130615
| Tanimoto metric | 0.8235 |
|---|---|
| Cosine metric | 0.9075 |
| Dice metric | 0.9032 |
| MW: | 140.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228960
Similarity: 0.7692
Similarity to MM228960
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8709 |
| Dice metric | 0.8696 |
| MW: | 154.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221667
Similarity: 0.7527
Similarity to MM221667
| Tanimoto metric | 0.7527 |
|---|---|
| Cosine metric | 0.8597 |
| Dice metric | 0.8589 |
| MW: | 158.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+277 more
