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DocumentationIdentifier: MM152810
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM152810 |
| SMILES |
CC(=O)NCCCC=O
|
| InChIKey |
DDSLGZOYEPKPSJ-UHFFFAOYSA-N
|
| MW [Da] |
129.16
Automatically obtained from RDkit software. |
| LogP |
0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM310211
Similarity: 0.7606
Similarity to MM310211
| Tanimoto metric | 0.7606 |
|---|---|
| Cosine metric | 0.864 |
| Dice metric | 0.864 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM63868
Similarity: 0.759
Similarity to MM63868
| Tanimoto metric | 0.759 |
|---|---|
| Cosine metric | 0.8712 |
| Dice metric | 0.863 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM152689
Similarity: 0.7571
Similarity to MM152689
| Tanimoto metric | 0.7571 |
|---|---|
| Cosine metric | 0.862 |
| Dice metric | 0.8618 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+635 more
