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DocumentationIdentifier: MM314406
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM314406 |
| SMILES |
CC(C=O)CCCCCO
|
| InChIKey |
YLWMHHHEUZGQLS-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM311223
Similarity: 0.8197
Similarity to MM311223
| Tanimoto metric | 0.8197 |
|---|---|
| Cosine metric | 0.9012 |
| Dice metric | 0.9009 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402802
Similarity: 0.7808
Similarity to MM402802
| Tanimoto metric | 0.7808 |
|---|---|
| Cosine metric | 0.8836 |
| Dice metric | 0.8769 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374026
Similarity: 0.7746
Similarity to MM374026
| Tanimoto metric | 0.7746 |
|---|---|
| Cosine metric | 0.877 |
| Dice metric | 0.873 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+522 more
