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DocumentationIdentifier: MM336608
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM336608 |
| SMILES |
CCC(C=O)C1NC1C=O
|
| InChIKey |
PRQVFUBLOVKSCG-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
-0.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM438962
Similarity: 0.7696
Similarity to MM438962
| Tanimoto metric | 0.7696 |
|---|---|
| Cosine metric | 0.8773 |
| Dice metric | 0.8698 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328367
Similarity: 0.7435
Similarity to MM328367
| Tanimoto metric | 0.7435 |
|---|---|
| Cosine metric | 0.8622 |
| Dice metric | 0.8529 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM437687
Similarity: 0.74
Similarity to MM437687
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.8547 |
| Dice metric | 0.8506 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+92 more
