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DocumentationIdentifier: MM314455
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM314455 |
| SMILES |
CCC(=O)CCCCCO
|
| InChIKey |
DSWFUOQBRIBDGN-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.52
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291721
Similarity: 0.8462
Similarity to MM291721
| Tanimoto metric | 0.8462 |
|---|---|
| Cosine metric | 0.9178 |
| Dice metric | 0.9167 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329732
Similarity: 0.8033
Similarity to MM329732
| Tanimoto metric | 0.8033 |
|---|---|
| Cosine metric | 0.8915 |
| Dice metric | 0.8909 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156085
Similarity: 0.7538
Similarity to MM156085
| Tanimoto metric | 0.7538 |
|---|---|
| Cosine metric | 0.8596 |
| Dice metric | 0.8596 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+342 more
