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DocumentationIdentifier: MM228887
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM228887 |
| SMILES |
N#CC(F)(F)C(F)(F)C#N
|
| InChIKey |
YNNRRZCWTDUBNT-UHFFFAOYSA-N
|
| MW [Da] |
152.05
Automatically obtained from RDkit software. |
| LogP |
1.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM137679
Similarity: 0.9355
Similarity to MM137679
| Tanimoto metric | 0.9355 |
|---|---|
| Cosine metric | 0.9672 |
| Dice metric | 0.9667 |
| MW: | 134.06 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM131037
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| Tanimoto metric | 0.914 |
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| Cosine metric | 0.956 |
| Dice metric | 0.9551 |
| MW: | 141.07 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM102585
Similarity: 0.7527
Similarity to MM102585
| Tanimoto metric | 0.7527 |
|---|---|
| Cosine metric | 0.8676 |
| Dice metric | 0.8589 |
| MW: | 123.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+33 more
