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DocumentationIdentifier: MM231688
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM231688 |
| SMILES |
NCC#CC(F)C(F)(F)F
|
| InChIKey |
UVHVJBXJQRDWEH-UHFFFAOYSA-N
|
| MW [Da] |
155.09
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163498
Similarity: 0.8421
Similarity to MM163498
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9177 |
| Dice metric | 0.9143 |
| MW: | 137.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235529
Similarity: 0.6923
Similarity to MM235529
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8189 |
| Dice metric | 0.8182 |
| MW: | 155.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231689
Similarity: 0.6522
Similarity to MM231689
| Tanimoto metric | 0.6522 |
|---|---|
| Cosine metric | 0.7895 |
| Dice metric | 0.7895 |
| MW: | 156.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+343 more
