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DocumentationIdentifier: MM243742
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243742 |
| SMILES |
N#CCC(F)(C#N)C(F)F
|
| InChIKey |
ANAHBVQSEBRDBR-UHFFFAOYSA-N
|
| MW [Da] |
148.09
Automatically obtained from RDkit software. |
| LogP |
1.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM388235
Similarity: 0.5427
Similarity to MM388235
| Tanimoto metric | 0.5427 |
|---|---|
| Cosine metric | 0.7048 |
| Dice metric | 0.7036 |
| MW: | 148.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243786
Similarity: 0.5027
Similarity to MM243786
| Tanimoto metric | 0.5027 |
|---|---|
| Cosine metric | 0.6693 |
| Dice metric | 0.6691 |
| MW: | 147.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM232036
Similarity: 0.4901
Similarity to MM232036
| Tanimoto metric | 0.4901 |
|---|---|
| Cosine metric | 0.6701 |
| Dice metric | 0.6578 |
| MW: | 148.09 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+38 more
