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DocumentationIdentifier: MM274600
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274600 |
| SMILES |
N=CNC(=CC(=N)N)CF
|
| InChIKey |
UMJXIBSUOOFVQT-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
-0.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM136504
Similarity: 0.708
Similarity to MM136504
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8291 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM178959
Similarity: 0.6861
Similarity to MM178959
| Tanimoto metric | 0.6861 |
|---|---|
| Cosine metric | 0.8283 |
| Dice metric | 0.8139 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM267727
Similarity: 0.6242
Similarity to MM267727
| Tanimoto metric | 0.6242 |
|---|---|
| Cosine metric | 0.7708 |
| Dice metric | 0.7686 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+94 more
