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DocumentationIdentifier: MM250499
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250499 |
| SMILES |
CCCC(O)COC(C)C
|
| InChIKey |
GFPVUDAELDVZSK-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
1.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144061
Similarity: 0.8267
Similarity to MM144061
| Tanimoto metric | 0.8267 |
|---|---|
| Cosine metric | 0.9092 |
| Dice metric | 0.9051 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291152
Similarity: 0.7975
Similarity to MM291152
| Tanimoto metric | 0.7975 |
|---|---|
| Cosine metric | 0.8887 |
| Dice metric | 0.8873 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69291
Similarity: 0.759
Similarity to MM69291
| Tanimoto metric | 0.759 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.863 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+660 more
