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DocumentationIdentifier: MM51718
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM51718 |
| SMILES |
CNCC=C(F)C(=O)NC
|
| InChIKey |
HKKBREPXUKUUSE-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM270592
Similarity: 0.8071
Similarity to MM270592
| Tanimoto metric | 0.8071 |
|---|---|
| Cosine metric | 0.8949 |
| Dice metric | 0.8933 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300730
Similarity: 0.7483
Similarity to MM300730
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.857 |
| Dice metric | 0.856 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295044
Similarity: 0.7424
Similarity to MM295044
| Tanimoto metric | 0.7424 |
|---|---|
| Cosine metric | 0.8527 |
| Dice metric | 0.8522 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+292 more
