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DocumentationIdentifier: MM354775
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354775 |
| SMILES |
C=CCNC(=O)C(F)=CC
|
| InChIKey |
ATPMHJGEQCDMPQ-UHFFFAOYSA-N
|
| MW [Da] |
143.16
Automatically obtained from RDkit software. |
| LogP |
1.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162734
Similarity: 0.7581
Similarity to MM162734
| Tanimoto metric | 0.7581 |
|---|---|
| Cosine metric | 0.8707 |
| Dice metric | 0.8624 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354776
Similarity: 0.7297
Similarity to MM354776
| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8442 |
| Dice metric | 0.8438 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85654
Similarity: 0.7248
Similarity to MM85654
| Tanimoto metric | 0.7248 |
|---|---|
| Cosine metric | 0.841 |
| Dice metric | 0.8405 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+280 more
