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DocumentationIdentifier: MM296836
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM296836 |
| SMILES |
CCCC(O)C(O)C(C)=O
|
| InChIKey |
WMONXLCFDLFZOM-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM253906
Similarity: 0.7419
Similarity to MM253906
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.852 |
| Dice metric | 0.8519 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160355
Similarity: 0.7295
Similarity to MM160355
| Tanimoto metric | 0.7295 |
|---|---|
| Cosine metric | 0.8444 |
| Dice metric | 0.8436 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM49991
Similarity: 0.7091
Similarity to MM49991
| Tanimoto metric | 0.7091 |
|---|---|
| Cosine metric | 0.8421 |
| Dice metric | 0.8298 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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