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DocumentationIdentifier: MM291119
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291119 |
| SMILES |
CCCC(O)CCOCC
|
| InChIKey |
XLVCDOVXBQMGJJ-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
1.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165525
Similarity: 0.8261
Similarity to MM165525
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.9089 |
| Dice metric | 0.9048 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83048
Similarity: 0.7733
Similarity to MM83048
| Tanimoto metric | 0.7733 |
|---|---|
| Cosine metric | 0.8728 |
| Dice metric | 0.8722 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM91001
Similarity: 0.7308
Similarity to MM91001
| Tanimoto metric | 0.7308 |
|---|---|
| Cosine metric | 0.8447 |
| Dice metric | 0.8444 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+671 more
