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DocumentationIdentifier: MM294704
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM294704 |
| SMILES |
CNC(=O)C=CC(C)(C)F
|
| InChIKey |
CWPQNOGLDGKHDH-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM283888
Similarity: 0.6985
Similarity to MM283888
| Tanimoto metric | 0.6985 |
|---|---|
| Cosine metric | 0.8227 |
| Dice metric | 0.8225 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264519
Similarity: 0.6835
Similarity to MM264519
| Tanimoto metric | 0.6835 |
|---|---|
| Cosine metric | 0.812 |
| Dice metric | 0.812 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274962
Similarity: 0.6419
Similarity to MM274962
| Tanimoto metric | 0.6419 |
|---|---|
| Cosine metric | 0.7822 |
| Dice metric | 0.7819 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+341 more
