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DocumentationIdentifier: MM248063
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM248063 |
| SMILES |
CNC(C)C=C(F)C(N)=O
|
| InChIKey |
DDQUCJZVLUUEBW-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM222742
Similarity: 0.6448
Similarity to MM222742
| Tanimoto metric | 0.6448 |
|---|---|
| Cosine metric | 0.7841 |
| Dice metric | 0.7841 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295044
Similarity: 0.5976
Similarity to MM295044
| Tanimoto metric | 0.5976 |
|---|---|
| Cosine metric | 0.757 |
| Dice metric | 0.7481 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51718
Similarity: 0.5789
Similarity to MM51718
| Tanimoto metric | 0.5789 |
|---|---|
| Cosine metric | 0.7385 |
| Dice metric | 0.7333 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+79 more
