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DocumentationIdentifier: MM351092
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM351092 |
| SMILES |
CCC(=O)C1NC1C=O
|
| InChIKey |
LZAOCYVVBVOXLI-UHFFFAOYSA-N
|
| MW [Da] |
127.14
Automatically obtained from RDkit software. |
| LogP |
-0.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM410063
Similarity: 0.8092
Similarity to MM410063
| Tanimoto metric | 0.8092 |
|---|---|
| Cosine metric | 0.8996 |
| Dice metric | 0.8945 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400791
Similarity: 0.7784
Similarity to MM400791
| Tanimoto metric | 0.7784 |
|---|---|
| Cosine metric | 0.8757 |
| Dice metric | 0.8754 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350823
Similarity: 0.7566
Similarity to MM350823
| Tanimoto metric | 0.7566 |
|---|---|
| Cosine metric | 0.8698 |
| Dice metric | 0.8614 |
| MW: | 113.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+66 more
