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DocumentationIdentifier: MM316320
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316320 |
| SMILES |
CCC(=O)CCC(O)CC
|
| InChIKey |
VJDZJBNTVLGPEM-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
MM250864
Similarity: 0.8293
Similarity to MM250864
| Tanimoto metric | 0.8293 |
|---|---|
| Cosine metric | 0.9087 |
| Dice metric | 0.9067 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250613
Similarity: 0.8293
Similarity to MM250613
| Tanimoto metric | 0.8293 |
|---|---|
| Cosine metric | 0.9087 |
| Dice metric | 0.9067 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM43774
Similarity: 0.825
Similarity to MM43774
| Tanimoto metric | 0.825 |
|---|---|
| Cosine metric | 0.9083 |
| Dice metric | 0.9041 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+305 more
