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DocumentationIdentifier: MM348794
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348794 |
| SMILES |
C=C(CF)C(O)C(N)CO
|
| InChIKey |
DUMKVRQUNCOYBW-UHFFFAOYSA-N
|
| MW [Da] |
149.17
Automatically obtained from RDkit software. |
| LogP |
-0.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM253965
Similarity: 0.665
Similarity to MM253965
| Tanimoto metric | 0.665 |
|---|---|
| Cosine metric | 0.799 |
| Dice metric | 0.7988 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348796
Similarity: 0.6468
Similarity to MM348796
| Tanimoto metric | 0.6468 |
|---|---|
| Cosine metric | 0.7856 |
| Dice metric | 0.7855 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348792
Similarity: 0.6373
Similarity to MM348792
| Tanimoto metric | 0.6373 |
|---|---|
| Cosine metric | 0.7785 |
| Dice metric | 0.7784 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+194 more
