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DocumentationIdentifier: MM300746
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM300746 |
| SMILES |
CCN(C=O)CCC(N)=O
|
| InChIKey |
CQXVIQPAXKTIGI-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.66
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM300510
Similarity: 0.8182
Similarity to MM300510
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9016 |
| Dice metric | 0.9 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM294870
Similarity: 0.7766
Similarity to MM294870
| Tanimoto metric | 0.7766 |
|---|---|
| Cosine metric | 0.8812 |
| Dice metric | 0.8743 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM317802
Similarity: 0.6822
Similarity to MM317802
| Tanimoto metric | 0.6822 |
|---|---|
| Cosine metric | 0.8119 |
| Dice metric | 0.8111 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+9 more
