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DocumentationIdentifier: MM253287
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253287 |
| SMILES |
C=CNC(=N)CC=C(F)F
|
| InChIKey |
TUOWHORBNIHNQN-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
1.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156927
Similarity: 0.8447
Similarity to MM156927
| Tanimoto metric | 0.8447 |
|---|---|
| Cosine metric | 0.9191 |
| Dice metric | 0.9158 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357070
Similarity: 0.7436
Similarity to MM357070
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.853 |
| Dice metric | 0.8529 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357068
Similarity: 0.7311
Similarity to MM357068
| Tanimoto metric | 0.7311 |
|---|---|
| Cosine metric | 0.8447 |
| Dice metric | 0.8447 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+122 more
