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DocumentationIdentifier: MM272062
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272062 |
| SMILES |
CC(F)CC(C=O)CCF
|
| InChIKey |
STYXXQRAKMGSAH-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149745
Similarity: 0.8941
Similarity to MM149745
| Tanimoto metric | 0.8941 |
|---|---|
| Cosine metric | 0.9456 |
| Dice metric | 0.9441 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272061
Similarity: 0.8889
Similarity to MM272061
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9412 |
| Dice metric | 0.9412 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326632
Similarity: 0.7692
Similarity to MM326632
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8721 |
| Dice metric | 0.8696 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+366 more
