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DocumentationIdentifier: MM335846
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM335846 |
| SMILES |
C=CN(C=O)C=C(F)CF
|
| InChIKey |
IRDANTIZIUJARK-UHFFFAOYSA-N
|
| MW [Da] |
147.12
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM150698
Similarity: 0.7586
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| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.871 |
| Dice metric | 0.8627 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM335922
Similarity: 0.6338
Similarity to MM335922
| Tanimoto metric | 0.6338 |
|---|---|
| Cosine metric | 0.7759 |
| Dice metric | 0.7759 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM335844
Similarity: 0.6294
Similarity to MM335844
| Tanimoto metric | 0.6294 |
|---|---|
| Cosine metric | 0.7725 |
| Dice metric | 0.7725 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+108 more
