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DocumentationIdentifier: MM363837
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363837 |
| SMILES |
O=CCCCCC(O)C=O
|
| InChIKey |
ZCEYZHSXUYATNY-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165920
Similarity: 0.9661
Similarity to MM165920
| Tanimoto metric | 0.9661 |
|---|---|
| Cosine metric | 0.9829 |
| Dice metric | 0.9828 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363544
Similarity: 0.9048
Similarity to MM363544
| Tanimoto metric | 0.9048 |
|---|---|
| Cosine metric | 0.9501 |
| Dice metric | 0.95 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363545
Similarity: 0.9048
Similarity to MM363545
| Tanimoto metric | 0.9048 |
|---|---|
| Cosine metric | 0.9501 |
| Dice metric | 0.95 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+390 more
