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DocumentationIdentifier: MM88159
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM88159 |
| SMILES |
N#CC(F)=C(F)CNC=N
|
| InChIKey |
NYOFTECZYZWWKX-UHFFFAOYSA-N
|
| MW [Da] |
145.11
Automatically obtained from RDkit software. |
| LogP |
0.86
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM164100
Similarity: 0.736
Similarity to MM164100
| Tanimoto metric | 0.736 |
|---|---|
| Cosine metric | 0.8579 |
| Dice metric | 0.8479 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88912
Similarity: 0.696
Similarity to MM88912
| Tanimoto metric | 0.696 |
|---|---|
| Cosine metric | 0.8343 |
| Dice metric | 0.8208 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM270703
Similarity: 0.6918
Similarity to MM270703
| Tanimoto metric | 0.6918 |
|---|---|
| Cosine metric | 0.8179 |
| Dice metric | 0.8178 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+104 more
