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DocumentationIdentifier: MM288150
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288150 |
| SMILES |
CC(=O)OCC=CCC=O
|
| InChIKey |
YBYIAXXVOZWMFI-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM215005
Similarity: 0.7662
Similarity to MM215005
| Tanimoto metric | 0.7662 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.8676 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369810
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Similarity to MM369810
| Tanimoto metric | 0.7444 |
|---|---|
| Cosine metric | 0.8537 |
| Dice metric | 0.8535 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM369214
Similarity: 0.7419
Similarity to MM369214
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8529 |
| Dice metric | 0.8519 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+229 more
