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DocumentationIdentifier: MM52194
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM52194 |
| SMILES |
CC(C)(N=CN)C(=O)CF
|
| InChIKey |
LVNANLCLJKKTQX-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172558
Similarity: 0.7383
Similarity to MM172558
| Tanimoto metric | 0.7383 |
|---|---|
| Cosine metric | 0.8592 |
| Dice metric | 0.8494 |
| MW: | 132.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM53787
Similarity: 0.6913
Similarity to MM53787
| Tanimoto metric | 0.6913 |
|---|---|
| Cosine metric | 0.8314 |
| Dice metric | 0.8175 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298277
Similarity: 0.6307
Similarity to MM298277
| Tanimoto metric | 0.6307 |
|---|---|
| Cosine metric | 0.7741 |
| Dice metric | 0.7735 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+27 more
