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DocumentationIdentifier: MM253098
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253098 |
| SMILES |
C#CC=C(F)C#CC(F)F
|
| InChIKey |
OVNMSHTVQFLDRC-UHFFFAOYSA-N
|
| MW [Da] |
144.1
Automatically obtained from RDkit software. |
| LogP |
1.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM146242
Similarity: 0.8471
Similarity to MM146242
| Tanimoto metric | 0.8471 |
|---|---|
| Cosine metric | 0.9204 |
| Dice metric | 0.9172 |
| MW: | 134.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159429
Similarity: 0.8118
Similarity to MM159429
| Tanimoto metric | 0.8118 |
|---|---|
| Cosine metric | 0.901 |
| Dice metric | 0.8961 |
| MW: | 126.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253086
Similarity: 0.6729
Similarity to MM253086
| Tanimoto metric | 0.6729 |
|---|---|
| Cosine metric | 0.8055 |
| Dice metric | 0.8045 |
| MW: | 148.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+420 more
