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DocumentationIdentifier: MM36173
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM36173 |
| SMILES |
C=CCNCC(F)(F)CO
|
| InChIKey |
BUZABWIBXBPVRN-UHFFFAOYSA-N
|
| MW [Da] |
151.16
Automatically obtained from RDkit software. |
| LogP |
0.39
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162913
Similarity: 0.7217
Similarity to MM162913
| Tanimoto metric | 0.7217 |
|---|---|
| Cosine metric | 0.8386 |
| Dice metric | 0.8384 |
| MW: | 155.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM232415
Similarity: 0.6404
Similarity to MM232415
| Tanimoto metric | 0.6404 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.7807 |
| MW: | 153.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM239463
Similarity: 0.5703
Similarity to MM239463
| Tanimoto metric | 0.5703 |
|---|---|
| Cosine metric | 0.7264 |
| Dice metric | 0.7264 |
| MW: | 153.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+150 more
