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DocumentationIdentifier: MM54803
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM54803 |
| SMILES |
CN(C)CC=C(F)CN
|
| InChIKey |
DNBJMFILEPTJJQ-UHFFFAOYSA-N
|
| MW [Da] |
132.18
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM114679
Similarity: 0.8116
Similarity to MM114679
| Tanimoto metric | 0.8116 |
|---|---|
| Cosine metric | 0.9009 |
| Dice metric | 0.896 |
| MW: | 118.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69938
Similarity: 0.7625
Similarity to MM69938
| Tanimoto metric | 0.7625 |
|---|---|
| Cosine metric | 0.8654 |
| Dice metric | 0.8652 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107802
Similarity: 0.6933
Similarity to MM107802
| Tanimoto metric | 0.6933 |
|---|---|
| Cosine metric | 0.822 |
| Dice metric | 0.8189 |
| MW: | 118.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+306 more
