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DocumentationIdentifier: MM355867
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355867 |
| SMILES |
CN(C=CCO)C(=O)CF
|
| InChIKey |
SDZSLWXXNRJENJ-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174181
Similarity: 0.8065
Similarity to MM174181
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355865
Similarity: 0.6174
Similarity to MM355865
| Tanimoto metric | 0.6174 |
|---|---|
| Cosine metric | 0.7638 |
| Dice metric | 0.7635 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM35633
Similarity: 0.6048
Similarity to MM35633
| Tanimoto metric | 0.6048 |
|---|---|
| Cosine metric | 0.7777 |
| Dice metric | 0.7538 |
| MW: | 117.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+443 more
