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DocumentationIdentifier: MM141731
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM141731 |
| SMILES |
CN(C=N)CC(F)CF
|
| InChIKey |
SPQSCJPMPHGCQX-UHFFFAOYSA-N
|
| MW [Da] |
136.15
Automatically obtained from RDkit software. |
| LogP |
0.83
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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MM327845
Similarity: 0.6911
Similarity to MM327845
| Tanimoto metric | 0.6911 |
|---|---|
| Cosine metric | 0.8313 |
| Dice metric | 0.8173 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM95955
Similarity: 0.62
Similarity to MM95955
| Tanimoto metric | 0.62 |
|---|---|
| Cosine metric | 0.7664 |
| Dice metric | 0.7654 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM135729
Similarity: 0.5905
Similarity to MM135729
| Tanimoto metric | 0.5905 |
|---|---|
| Cosine metric | 0.7426 |
| Dice metric | 0.7425 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+354 more
