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DocumentationIdentifier: MM220546
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM220546 |
| SMILES |
CC(F)(F)C#CC(C)(F)F
|
| InChIKey |
GINRMDCZJUDARM-UHFFFAOYSA-N
|
| MW [Da] |
154.11
Automatically obtained from RDkit software. |
| LogP |
2.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130514
Similarity: 0.9697
Similarity to MM130514
| Tanimoto metric | 0.9697 |
|---|---|
| Cosine metric | 0.9847 |
| Dice metric | 0.9846 |
| MW: | 136.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM130515
Similarity: 0.8788
Similarity to MM130515
| Tanimoto metric | 0.8788 |
|---|---|
| Cosine metric | 0.9374 |
| Dice metric | 0.9355 |
| MW: | 140.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM102894
Similarity: 0.7879
Similarity to MM102894
| Tanimoto metric | 0.7879 |
|---|---|
| Cosine metric | 0.8876 |
| Dice metric | 0.8814 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+539 more
