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DocumentationIdentifier: MM261578
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261578 |
| SMILES |
CCCC(F)CN(C)C=O
|
| InChIKey |
DLKJYJVZUYJEOU-UHFFFAOYSA-N
|
| MW [Da] |
147.19
Automatically obtained from RDkit software. |
| LogP |
1.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM24687
Similarity: 0.8302
Similarity to MM24687
| Tanimoto metric | 0.8302 |
|---|---|
| Cosine metric | 0.9111 |
| Dice metric | 0.9072 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261691
Similarity: 0.6984
Similarity to MM261691
| Tanimoto metric | 0.6984 |
|---|---|
| Cosine metric | 0.8225 |
| Dice metric | 0.8224 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24703
Similarity: 0.6899
Similarity to MM24703
| Tanimoto metric | 0.6899 |
|---|---|
| Cosine metric | 0.8168 |
| Dice metric | 0.8165 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+250 more
