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DocumentationIdentifier: MM247417
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM247417 |
| SMILES |
CCC(F)=CC(C)C(=N)N
|
| InChIKey |
KFLZHXNJLYQTKH-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.82
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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MM134106
Similarity: 0.806
Similarity to MM134106
| Tanimoto metric | 0.806 |
|---|---|
| Cosine metric | 0.8978 |
| Dice metric | 0.8926 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM146623
Similarity: 0.6716
Similarity to MM146623
| Tanimoto metric | 0.6716 |
|---|---|
| Cosine metric | 0.8195 |
| Dice metric | 0.8036 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM256044
Similarity: 0.6644
Similarity to MM256044
| Tanimoto metric | 0.6644 |
|---|---|
| Cosine metric | 0.8026 |
| Dice metric | 0.7984 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+266 more
