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DocumentationIdentifier: MM292334
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292334 |
| SMILES |
C=C(CCCC=O)OC=O
|
| InChIKey |
IOIYYALNHLQFJS-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
MM90756
Similarity: 0.717
Similarity to MM90756
| Tanimoto metric | 0.717 |
|---|---|
| Cosine metric | 0.8352 |
| Dice metric | 0.8352 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292412
Similarity: 0.7037
Similarity to MM292412
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8263 |
| Dice metric | 0.8261 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292124
Similarity: 0.7037
Similarity to MM292124
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8263 |
| Dice metric | 0.8261 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+175 more
