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DocumentationIdentifier: MM364416
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364416 |
| SMILES |
COCCCCC(=O)CO
|
| InChIKey |
IPCLXDNPNAWOEV-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM152630
Similarity: 0.8261
Similarity to MM152630
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.9089 |
| Dice metric | 0.9048 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156099
Similarity: 0.7922
Similarity to MM156099
| Tanimoto metric | 0.7922 |
|---|---|
| Cosine metric | 0.8841 |
| Dice metric | 0.8841 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62903
Similarity: 0.7882
Similarity to MM62903
| Tanimoto metric | 0.7882 |
|---|---|
| Cosine metric | 0.8853 |
| Dice metric | 0.8816 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+426 more
