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DocumentationIdentifier: MM57653
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM57653 |
| SMILES |
CCN(C)CCN(C)C=O
|
| InChIKey |
UYJJNEPXGWPVSH-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM55110
Similarity: 0.9118
Similarity to MM55110
| Tanimoto metric | 0.9118 |
|---|---|
| Cosine metric | 0.954 |
| Dice metric | 0.9538 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM166034
Similarity: 0.8438
Similarity to MM166034
| Tanimoto metric | 0.8438 |
|---|---|
| Cosine metric | 0.9186 |
| Dice metric | 0.9153 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69759
Similarity: 0.8235
Similarity to MM69759
| Tanimoto metric | 0.8235 |
|---|---|
| Cosine metric | 0.9037 |
| Dice metric | 0.9032 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+170 more
