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DocumentationIdentifier: MM60775
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM60775 |
| SMILES |
CC(C#N)(CF)C(=N)N
|
| InChIKey |
PNNZPHWKZUUKGZ-UHFFFAOYSA-N
|
| MW [Da] |
129.14
Automatically obtained from RDkit software. |
| LogP |
0.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM60392
Similarity: 0.7429
Similarity to MM60392
| Tanimoto metric | 0.7429 |
|---|---|
| Cosine metric | 0.8619 |
| Dice metric | 0.8525 |
| MW: | 115.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM65948
Similarity: 0.7143
Similarity to MM65948
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 143.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM48517
Similarity: 0.6325
Similarity to MM48517
| Tanimoto metric | 0.6325 |
|---|---|
| Cosine metric | 0.7953 |
| Dice metric | 0.7749 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+108 more
