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DocumentationIdentifier: MM174919
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM174919 |
| SMILES |
C=CNC(=O)C(F)=CC
|
| InChIKey |
CXHHDJGTHZHHRJ-UHFFFAOYSA-N
|
| MW [Da] |
129.13
Automatically obtained from RDkit software. |
| LogP |
1.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM354939
Similarity: 0.8682
Similarity to MM354939
| Tanimoto metric | 0.8682 |
|---|---|
| Cosine metric | 0.9318 |
| Dice metric | 0.9295 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296634
Similarity: 0.8
Similarity to MM296634
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 139.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296587
Similarity: 0.7943
Similarity to MM296587
| Tanimoto metric | 0.7943 |
|---|---|
| Cosine metric | 0.8912 |
| Dice metric | 0.8854 |
| MW: | 140.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+300 more
