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DocumentationIdentifier: MM231930
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM231930 |
| SMILES |
COCC(CO)C(C)(F)F
|
| InChIKey |
NVPBWELSNPDXOP-UHFFFAOYSA-N
|
| MW [Da] |
154.16
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM102550
Similarity: 0.6408
Similarity to MM102550
| Tanimoto metric | 0.6408 |
|---|---|
| Cosine metric | 0.8005 |
| Dice metric | 0.7811 |
| MW: | 124.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM232016
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Similarity to MM232016
| Tanimoto metric | 0.5946 |
|---|---|
| Cosine metric | 0.7519 |
| Dice metric | 0.7458 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM108078
Similarity: 0.5825
Similarity to MM108078
| Tanimoto metric | 0.5825 |
|---|---|
| Cosine metric | 0.7632 |
| Dice metric | 0.7362 |
| MW: | 120.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+339 more
