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DocumentationIdentifier: MM102588
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM102588 |
| SMILES |
N#CC(F)C(F)(F)F
|
| InChIKey |
CFPAMJZAMYOJER-UHFFFAOYSA-N
|
| MW [Da] |
127.04
Automatically obtained from RDkit software. |
| LogP |
1.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM98439
Similarity: 0.7586
Similarity to MM98439
| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.871 |
| Dice metric | 0.8627 |
| MW: | 109.05 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM131039
Similarity: 0.7436
Similarity to MM131039
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.8623 |
| Dice metric | 0.8529 |
| MW: | 145.03 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM103293
Similarity: 0.5946
Similarity to MM103293
| Tanimoto metric | 0.5946 |
|---|---|
| Cosine metric | 0.7459 |
| Dice metric | 0.7458 |
| MW: | 127.04 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+56 more
