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DocumentationIdentifier: MM222826
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222826 |
| SMILES |
CC(=O)C(C)(C)C(C)(C)F
|
| InChIKey |
DTAXVEWYZXPJQQ-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
2.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM129870
Similarity: 0.7556
Similarity to MM129870
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8692 |
| Dice metric | 0.8608 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132911
Similarity: 0.7481
Similarity to MM132911
| Tanimoto metric | 0.7481 |
|---|---|
| Cosine metric | 0.865 |
| Dice metric | 0.8559 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244349
Similarity: 0.6299
Similarity to MM244349
| Tanimoto metric | 0.6299 |
|---|---|
| Cosine metric | 0.7751 |
| Dice metric | 0.7729 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+178 more
