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DocumentationIdentifier: MM253321
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253321 |
| SMILES |
CC(F)=COC(=O)CC=O
|
| InChIKey |
FIMMJHUYVUXNBD-UHFFFAOYSA-N
|
| MW [Da] |
146.12
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM253320
Similarity: 0.7293
Similarity to MM253320
| Tanimoto metric | 0.7293 |
|---|---|
| Cosine metric | 0.8435 |
| Dice metric | 0.8435 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156996
Similarity: 0.713
Similarity to MM156996
| Tanimoto metric | 0.713 |
|---|---|
| Cosine metric | 0.8444 |
| Dice metric | 0.8325 |
| MW: | 132.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325364
Similarity: 0.7122
Similarity to MM325364
| Tanimoto metric | 0.7122 |
|---|---|
| Cosine metric | 0.8324 |
| Dice metric | 0.8319 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+255 more
