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DocumentationIdentifier: MM263499
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263499 |
| SMILES |
C=C(CC=O)OC(=O)CC
|
| InChIKey |
JYXGXJVXMUJWKL-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142666
Similarity: 0.8053
Similarity to MM142666
| Tanimoto metric | 0.8053 |
|---|---|
| Cosine metric | 0.8974 |
| Dice metric | 0.8922 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263502
Similarity: 0.7045
Similarity to MM263502
| Tanimoto metric | 0.7045 |
|---|---|
| Cosine metric | 0.8267 |
| Dice metric | 0.8267 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246366
Similarity: 0.6765
Similarity to MM246366
| Tanimoto metric | 0.6765 |
|---|---|
| Cosine metric | 0.807 |
| Dice metric | 0.807 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+292 more
