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DocumentationIdentifier: MM226037
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM226037 |
| SMILES |
OCC(O)CC(F)(F)CO
|
| InChIKey |
BXWULQHIAWUZIV-UHFFFAOYSA-N
|
| MW [Da] |
156.13
Automatically obtained from RDkit software. |
| LogP |
-0.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130001
Similarity: 0.7521
Similarity to MM130001
| Tanimoto metric | 0.7521 |
|---|---|
| Cosine metric | 0.8673 |
| Dice metric | 0.8585 |
| MW: | 140.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141554
Similarity: 0.6838
Similarity to MM141554
| Tanimoto metric | 0.6838 |
|---|---|
| Cosine metric | 0.8269 |
| Dice metric | 0.8122 |
| MW: | 138.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM226035
Similarity: 0.6715
Similarity to MM226035
| Tanimoto metric | 0.6715 |
|---|---|
| Cosine metric | 0.8037 |
| Dice metric | 0.8035 |
| MW: | 154.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+322 more
