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DocumentationIdentifier: MM73213
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM73213 |
| SMILES |
CCC(CN)C(C)NC=O
|
| InChIKey |
QPUQQBMEPBDAHL-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM81668
Similarity: 0.7652
Similarity to MM81668
| Tanimoto metric | 0.7652 |
|---|---|
| Cosine metric | 0.8694 |
| Dice metric | 0.867 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316095
Similarity: 0.7339
Similarity to MM316095
| Tanimoto metric | 0.7339 |
|---|---|
| Cosine metric | 0.8567 |
| Dice metric | 0.8466 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM73448
Similarity: 0.7236
Similarity to MM73448
| Tanimoto metric | 0.7236 |
|---|---|
| Cosine metric | 0.84 |
| Dice metric | 0.8396 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+220 more
