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DocumentationIdentifier: MM236563
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM236563 |
| SMILES |
CC(=O)CC(F)CCCF
|
| InChIKey |
PFTMFUCWCRXXFY-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
2.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM261858
Similarity: 0.8316
Similarity to MM261858
| Tanimoto metric | 0.8316 |
|---|---|
| Cosine metric | 0.9102 |
| Dice metric | 0.908 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104292
Similarity: 0.7037
Similarity to MM104292
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8389 |
| Dice metric | 0.8261 |
| MW: | 118.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141956
Similarity: 0.6923
Similarity to MM141956
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8193 |
| Dice metric | 0.8182 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+280 more
