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DocumentationIdentifier: MM263572
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263572 |
| SMILES |
C=C(C=O)CC(=O)CCC
|
| InChIKey |
XIVYMEYIMUYNMA-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
1.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142686
Similarity: 0.8778
Similarity to MM142686
| Tanimoto metric | 0.8778 |
|---|---|
| Cosine metric | 0.9369 |
| Dice metric | 0.9349 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263671
Similarity: 0.8469
Similarity to MM263671
| Tanimoto metric | 0.8469 |
|---|---|
| Cosine metric | 0.9171 |
| Dice metric | 0.9171 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246781
Similarity: 0.7477
Similarity to MM246781
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8579 |
| Dice metric | 0.8557 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+289 more
