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DocumentationIdentifier: MM308091
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308091 |
| SMILES |
CC(C)C(C(=O)O)C(F)F
|
| InChIKey |
CROGKHYMIQYHLF-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
1.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM315396
Similarity: 0.7047
Similarity to MM315396
| Tanimoto metric | 0.7047 |
|---|---|
| Cosine metric | 0.8268 |
| Dice metric | 0.8268 |
| MW: | 152.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306776
Similarity: 0.6887
Similarity to MM306776
| Tanimoto metric | 0.6887 |
|---|---|
| Cosine metric | 0.8157 |
| Dice metric | 0.8157 |
| MW: | 156.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306774
Similarity: 0.6623
Similarity to MM306774
| Tanimoto metric | 0.6623 |
|---|---|
| Cosine metric | 0.7969 |
| Dice metric | 0.7969 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+218 more
