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DocumentationIdentifier: MM223531
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223531 |
| SMILES |
C=C(C)C=C(F)CC(=N)N
|
| InChIKey |
FSNPDIHKMRDLHA-UHFFFAOYSA-N
|
| MW [Da] |
142.18
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
MM136100
Similarity: 0.75
Similarity to MM136100
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM256135
Similarity: 0.6859
Similarity to MM256135
| Tanimoto metric | 0.6859 |
|---|---|
| Cosine metric | 0.8137 |
| Dice metric | 0.8137 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238029
Similarity: 0.6828
Similarity to MM238029
| Tanimoto metric | 0.6828 |
|---|---|
| Cosine metric | 0.8142 |
| Dice metric | 0.8115 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+99 more
