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DocumentationIdentifier: MM361221
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361221 |
| SMILES |
CC(=CC=CF)N(C)C=N
|
| InChIKey |
PHJAMOSLBHKQQN-UHFFFAOYSA-N
|
| MW [Da] |
142.18
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175359
Similarity: 0.8182
Similarity to MM175359
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM361219
Similarity: 0.7258
Similarity to MM361219
| Tanimoto metric | 0.7258 |
|---|---|
| Cosine metric | 0.8415 |
| Dice metric | 0.8411 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383272
Similarity: 0.6233
Similarity to MM383272
| Tanimoto metric | 0.6233 |
|---|---|
| Cosine metric | 0.7699 |
| Dice metric | 0.7679 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+205 more
