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DocumentationIdentifier: MM68344
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM68344 |
| SMILES |
CC(O)CCCOCCO
|
| InChIKey |
MLGNYLJPENXZDQ-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM212854
Similarity: 0.7931
Similarity to MM212854
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM90993
Similarity: 0.7536
Similarity to MM90993
| Tanimoto metric | 0.7536 |
|---|---|
| Cosine metric | 0.8602 |
| Dice metric | 0.8595 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362828
Similarity: 0.7353
Similarity to MM362828
| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8476 |
| Dice metric | 0.8475 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+790 more
