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DocumentationIdentifier: MM243566
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243566 |
| SMILES |
CC(O)C(F)(CO)CCO
|
| InChIKey |
IXFPFPGKRHFROD-UHFFFAOYSA-N
|
| MW [Da] |
152.17
Automatically obtained from RDkit software. |
| LogP |
-0.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM40443
Similarity: 0.7786
Similarity to MM40443
| Tanimoto metric | 0.7786 |
|---|---|
| Cosine metric | 0.8824 |
| Dice metric | 0.8755 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM41473
Similarity: 0.6552
Similarity to MM41473
| Tanimoto metric | 0.6552 |
|---|---|
| Cosine metric | 0.795 |
| Dice metric | 0.7917 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228954
Similarity: 0.6443
Similarity to MM228954
| Tanimoto metric | 0.6443 |
|---|---|
| Cosine metric | 0.7856 |
| Dice metric | 0.7837 |
| MW: | 152.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+216 more
