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DocumentationIdentifier: MM222820
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222820 |
| SMILES |
CC(=O)C(C)(C)C(C)(C)O
|
| InChIKey |
OMVOGGRXOPWJJY-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM229800
Similarity: 0.7432
Similarity to MM229800
| Tanimoto metric | 0.7432 |
|---|---|
| Cosine metric | 0.854 |
| Dice metric | 0.8527 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132909
Similarity: 0.7279
Similarity to MM132909
| Tanimoto metric | 0.7279 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8426 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234653
Similarity: 0.6182
Similarity to MM234653
| Tanimoto metric | 0.6182 |
|---|---|
| Cosine metric | 0.7642 |
| Dice metric | 0.764 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+188 more
