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DocumentationIdentifier: MM262598
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262598 |
| SMILES |
CC(CO)OC(=O)CC=O
|
| InChIKey |
UWFDVEMSKSKDOL-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-0.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM262480
Similarity: 0.7636
Similarity to MM262480
| Tanimoto metric | 0.7636 |
|---|---|
| Cosine metric | 0.8664 |
| Dice metric | 0.866 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135445
Similarity: 0.74
Similarity to MM135445
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.8602 |
| Dice metric | 0.8506 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246023
Similarity: 0.7009
Similarity to MM246023
| Tanimoto metric | 0.7009 |
|---|---|
| Cosine metric | 0.8241 |
| Dice metric | 0.8241 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+283 more
