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DocumentationIdentifier: MM351470
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351470 |
| SMILES |
C#CC(F)C(=O)C(C)OC
|
| InChIKey |
LVKQNHNWMIDDCC-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
0.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM47539
Similarity: 0.7457
Similarity to MM47539
| Tanimoto metric | 0.7457 |
|---|---|
| Cosine metric | 0.8635 |
| Dice metric | 0.8543 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351456
Similarity: 0.6028
Similarity to MM351456
| Tanimoto metric | 0.6028 |
|---|---|
| Cosine metric | 0.7522 |
| Dice metric | 0.7522 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351699
Similarity: 0.6009
Similarity to MM351699
| Tanimoto metric | 0.6009 |
|---|---|
| Cosine metric | 0.7507 |
| Dice metric | 0.7507 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+90 more
