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DocumentationIdentifier: MM253231
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253231 |
| SMILES |
CCNC(=N)CC=C(F)F
|
| InChIKey |
JTEYJIJUNODNFM-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
1.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM356836
Similarity: 0.7636
Similarity to MM356836
| Tanimoto metric | 0.7636 |
|---|---|
| Cosine metric | 0.8662 |
| Dice metric | 0.866 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356606
Similarity: 0.7615
Similarity to MM356606
| Tanimoto metric | 0.7615 |
|---|---|
| Cosine metric | 0.865 |
| Dice metric | 0.8646 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237220
Similarity: 0.7345
Similarity to MM237220
| Tanimoto metric | 0.7345 |
|---|---|
| Cosine metric | 0.847 |
| Dice metric | 0.8469 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+231 more
