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DocumentationIdentifier: MM113065
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM113065 |
| SMILES |
O=C(CF)NCCF
|
| InChIKey |
YCDIIABELFVSKJ-UHFFFAOYSA-N
|
| MW [Da] |
123.1
Automatically obtained from RDkit software. |
| LogP |
0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM26386
Similarity: 0.8491
Similarity to MM26386
| Tanimoto metric | 0.8491 |
|---|---|
| Cosine metric | 0.9214 |
| Dice metric | 0.9184 |
| MW: | 105.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM25853
Similarity: 0.7925
Similarity to MM25853
| Tanimoto metric | 0.7925 |
|---|---|
| Cosine metric | 0.8902 |
| Dice metric | 0.8842 |
| MW: | 105.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM113211
Similarity: 0.6716
Similarity to MM113211
| Tanimoto metric | 0.6716 |
|---|---|
| Cosine metric | 0.8047 |
| Dice metric | 0.8036 |
| MW: | 119.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+388 more
