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DocumentationIdentifier: MM291152
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291152 |
| SMILES |
CCCOCC(O)CCC
|
| InChIKey |
UVSKAZAWMVGOKD-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
MM69291
Similarity: 0.8904
Similarity to MM69291
| Tanimoto metric | 0.8904 |
|---|---|
| Cosine metric | 0.9424 |
| Dice metric | 0.942 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83053
Similarity: 0.8289
Similarity to MM83053
| Tanimoto metric | 0.8289 |
|---|---|
| Cosine metric | 0.9071 |
| Dice metric | 0.9065 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165592
Similarity: 0.8209
Similarity to MM165592
| Tanimoto metric | 0.8209 |
|---|---|
| Cosine metric | 0.906 |
| Dice metric | 0.9016 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+755 more
