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DocumentationIdentifier: MM368223
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM368223 |
| SMILES |
CN(CC=O)CC(F)=CF
|
| InChIKey |
BEHJCXFFOURKDO-UHFFFAOYSA-N
|
| MW [Da] |
149.14
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM51936
Similarity: 0.7615
Similarity to MM51936
| Tanimoto metric | 0.7615 |
|---|---|
| Cosine metric | 0.8726 |
| Dice metric | 0.8646 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.6563 |
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| Cosine metric | 0.7928 |
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| MW: | 153.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM265020
Similarity: 0.6148
Similarity to MM265020
| Tanimoto metric | 0.6148 |
|---|---|
| Cosine metric | 0.7615 |
| Dice metric | 0.7615 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
