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DocumentationIdentifier: MM64828
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM64828 |
| SMILES |
CCCC(=O)CC(O)CF
|
| InChIKey |
JKZFMIHNCZBLHF-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM244915
Similarity: 0.7068
Similarity to MM244915
| Tanimoto metric | 0.7068 |
|---|---|
| Cosine metric | 0.8333 |
| Dice metric | 0.8282 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262517
Similarity: 0.7008
Similarity to MM262517
| Tanimoto metric | 0.7008 |
|---|---|
| Cosine metric | 0.8258 |
| Dice metric | 0.8241 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262636
Similarity: 0.6899
Similarity to MM262636
| Tanimoto metric | 0.6899 |
|---|---|
| Cosine metric | 0.8187 |
| Dice metric | 0.8165 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+247 more
