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DocumentationIdentifier: MM317802
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM317802 |
| SMILES |
CNC(=O)CCN(C)C=O
|
| InChIKey |
YLNIONPZDMDEHS-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM294870
Similarity: 0.8488
Similarity to MM294870
| Tanimoto metric | 0.8488 |
|---|---|
| Cosine metric | 0.9213 |
| Dice metric | 0.9182 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300746
Similarity: 0.6822
Similarity to MM300746
| Tanimoto metric | 0.6822 |
|---|---|
| Cosine metric | 0.8119 |
| Dice metric | 0.8111 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300510
Similarity: 0.641
Similarity to MM300510
| Tanimoto metric | 0.641 |
|---|---|
| Cosine metric | 0.7855 |
| Dice metric | 0.7813 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+349 more
