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DocumentationIdentifier: MM352365
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352365 |
| SMILES |
C=C(C=O)C(=O)CCC=O
|
| InChIKey |
HJZMGNTZPGLOQX-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162690
Similarity: 0.7938
Similarity to MM162690
| Tanimoto metric | 0.7938 |
|---|---|
| Cosine metric | 0.891 |
| Dice metric | 0.8851 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352361
Similarity: 0.7522
Similarity to MM352361
| Tanimoto metric | 0.7522 |
|---|---|
| Cosine metric | 0.8588 |
| Dice metric | 0.8586 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298975
Similarity: 0.7203
Similarity to MM298975
| Tanimoto metric | 0.7203 |
|---|---|
| Cosine metric | 0.8383 |
| Dice metric | 0.8374 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+100 more
