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DocumentationIdentifier: MM251631
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM251631 |
| SMILES |
C=C(F)CNC(=N)C=CN
|
| InChIKey |
FYGBXCVMJYQANZ-UHFFFAOYSA-N
|
| MW [Da] |
143.17
Automatically obtained from RDkit software. |
| LogP |
0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM145134
Similarity: 0.8019
Similarity to MM145134
| Tanimoto metric | 0.8019 |
|---|---|
| Cosine metric | 0.8955 |
| Dice metric | 0.8901 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251630
Similarity: 0.68
Similarity to MM251630
| Tanimoto metric | 0.68 |
|---|---|
| Cosine metric | 0.8096 |
| Dice metric | 0.8095 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM320719
Similarity: 0.6615
Similarity to MM320719
| Tanimoto metric | 0.6615 |
|---|---|
| Cosine metric | 0.7964 |
| Dice metric | 0.7963 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+200 more
