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DocumentationIdentifier: MM354689
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354689 |
| SMILES |
CNC(=O)C(F)=C(F)CF
|
| InChIKey |
LDLXDOIAPGPAKT-UHFFFAOYSA-N
|
| MW [Da] |
153.1
Automatically obtained from RDkit software. |
| LogP |
0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161633
Similarity: 0.7529
Similarity to MM161633
| Tanimoto metric | 0.7529 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8591 |
| MW: | 135.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM161820
Similarity: 0.7412
Similarity to MM161820
| Tanimoto metric | 0.7412 |
|---|---|
| Cosine metric | 0.8609 |
| Dice metric | 0.8514 |
| MW: | 139.08 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM175485
Similarity: 0.6588
Similarity to MM175485
| Tanimoto metric | 0.6588 |
|---|---|
| Cosine metric | 0.8117 |
| Dice metric | 0.7943 |
| MW: | 135.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+100 more
