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DocumentationIdentifier: MM260455
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM260455 |
| SMILES |
CC(C=O)CCC=C(F)F
|
| InChIKey |
QZRFNKUOFCGWLM-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167246
Similarity: 0.8472
Similarity to MM167246
| Tanimoto metric | 0.8472 |
|---|---|
| Cosine metric | 0.9204 |
| Dice metric | 0.9173 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238090
Similarity: 0.7079
Similarity to MM238090
| Tanimoto metric | 0.7079 |
|---|---|
| Cosine metric | 0.8301 |
| Dice metric | 0.8289 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352822
Similarity: 0.6667
Similarity to MM352822
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.802 |
| Dice metric | 0.8 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+610 more
