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DocumentationIdentifier: MM233823
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233823 |
| SMILES |
CNCC(F)(F)CNC=N
|
| InChIKey |
HTAKHFFRMGEYPW-UHFFFAOYSA-N
|
| MW [Da] |
151.16
Automatically obtained from RDkit software. |
| LogP |
0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM96134
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Similarity to MM96134
| Tanimoto metric | 0.7381 |
|---|---|
| Cosine metric | 0.8591 |
| Dice metric | 0.8493 |
| MW: | 122.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM112667
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| Tanimoto metric | 0.6667 |
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| Cosine metric | 0.8165 |
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| MW: | 119.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM131621
Similarity: 0.6263
Similarity to MM131621
| Tanimoto metric | 0.6263 |
|---|---|
| Cosine metric | 0.7709 |
| Dice metric | 0.7702 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
