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DocumentationIdentifier: MM258370
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM258370 |
| SMILES |
COC(=O)COCC(N)=O
|
| InChIKey |
BGDOLWFAQLJWPC-UHFFFAOYSA-N
|
| MW [Da] |
147.13
Automatically obtained from RDkit software. |
| LogP |
-1.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166438
Similarity: 0.7692
Similarity to MM166438
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251167
Similarity: 0.7232
Similarity to MM251167
| Tanimoto metric | 0.7232 |
|---|---|
| Cosine metric | 0.8407 |
| Dice metric | 0.8394 |
| MW: | 147.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291789
Similarity: 0.7071
Similarity to MM291789
| Tanimoto metric | 0.7071 |
|---|---|
| Cosine metric | 0.8309 |
| Dice metric | 0.8284 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+225 more
