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DocumentationIdentifier: MM28655
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM28655 |
| SMILES |
CC(O)C(C)(F)CO
|
| InChIKey |
CVNHBFZUYPORBG-UHFFFAOYSA-N
|
| MW [Da] |
122.14
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130997
Similarity: 0.7019
Similarity to MM130997
| Tanimoto metric | 0.7019 |
|---|---|
| Cosine metric | 0.8378 |
| Dice metric | 0.8249 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35084
Similarity: 0.6883
Similarity to MM35084
| Tanimoto metric | 0.6883 |
|---|---|
| Cosine metric | 0.8216 |
| Dice metric | 0.8154 |
| MW: | 122.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM97122
Similarity: 0.6849
Similarity to MM97122
| Tanimoto metric | 0.6849 |
|---|---|
| Cosine metric | 0.8276 |
| Dice metric | 0.813 |
| MW: | 106.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+425 more
