Identifier: MM171663
2D Structure
3D Structure
Source:
General | |
Identifier | MM171663 |
SMILES |
C#CC#CC=C(F)CF
|
InChIKey |
XLVIMUWIRYGCJV-UHFFFAOYSA-N
|
MW [Da] |
126.11
Automatically obtained from RDkit software. |
LogP |
1.45
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM372052
Similarity: 0.9
Similarity to MM372052
Tanimoto metric | 0.9 |
---|---|
Cosine metric | 0.9487 |
Dice metric | 0.9474 |
MW: | 140.13 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.84 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM114914
Similarity: 0.8056
Similarity to MM114914
Tanimoto metric | 0.8056 |
---|---|
Cosine metric | 0.8975 |
Dice metric | 0.8923 |
MW: | 116.11 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.83 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM106673
Similarity: 0.7361
Similarity to MM106673
Tanimoto metric | 0.7361 |
---|---|
Cosine metric | 0.858 |
Dice metric | 0.848 |
MW: | 108.12 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+512 more