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DocumentationIdentifier: MM254554
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254554 |
| SMILES |
C=C(F)CCC(C)C(F)F
|
| InChIKey |
GLUPWUCXCAVOAJ-UHFFFAOYSA-N
|
| MW [Da] |
152.16
Automatically obtained from RDkit software. |
| LogP |
3.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162023
Similarity: 0.75
Similarity to MM162023
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340419
Similarity: 0.7065
Similarity to MM340419
| Tanimoto metric | 0.7065 |
|---|---|
| Cosine metric | 0.8301 |
| Dice metric | 0.828 |
| MW: | 152.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133016
Similarity: 0.6905
Similarity to MM133016
| Tanimoto metric | 0.6905 |
|---|---|
| Cosine metric | 0.8309 |
| Dice metric | 0.8169 |
| MW: | 138.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+477 more
