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DocumentationIdentifier: MM265829
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265829 |
| SMILES |
CNC(=N)CC(F)=CCF
|
| InChIKey |
QSIRLMQQFUBIFP-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
1.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143082
Similarity: 0.8182
Similarity to MM143082
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265828
Similarity: 0.7483
Similarity to MM265828
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.856 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265056
Similarity: 0.7171
Similarity to MM265056
| Tanimoto metric | 0.7171 |
|---|---|
| Cosine metric | 0.8353 |
| Dice metric | 0.8352 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+236 more
