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DocumentationIdentifier: MM306692
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM306692 |
| SMILES |
CC(C)C(OC=O)C(F)F
|
| InChIKey |
JTEUPFOFSQZADS-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM305137
Similarity: 0.6522
Similarity to MM305137
| Tanimoto metric | 0.6522 |
|---|---|
| Cosine metric | 0.7896 |
| Dice metric | 0.7895 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375980
Similarity: 0.6042
Similarity to MM375980
| Tanimoto metric | 0.6042 |
|---|---|
| Cosine metric | 0.7536 |
| Dice metric | 0.7532 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM115973
Similarity: 0.5804
Similarity to MM115973
| Tanimoto metric | 0.5804 |
|---|---|
| Cosine metric | 0.7618 |
| Dice metric | 0.7345 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
