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DocumentationIdentifier: MM378159
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378159 |
| SMILES |
C=CCN(C=O)C=CCO
|
| InChIKey |
HKYAWCLDFXNUMT-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM378163
Similarity: 0.6942
Similarity to MM378163
| Tanimoto metric | 0.6942 |
|---|---|
| Cosine metric | 0.8195 |
| Dice metric | 0.8195 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378267
Similarity: 0.675
Similarity to MM378267
| Tanimoto metric | 0.675 |
|---|---|
| Cosine metric | 0.8061 |
| Dice metric | 0.806 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378344
Similarity: 0.6639
Similarity to MM378344
| Tanimoto metric | 0.6639 |
|---|---|
| Cosine metric | 0.798 |
| Dice metric | 0.798 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+237 more
