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DocumentationIdentifier: MM92496
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM92496 |
| SMILES |
C=CC(=O)OC=CNC=O
|
| InChIKey |
AVMYRFJNCGJLQN-UHFFFAOYSA-N
|
| MW [Da] |
141.13
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM45277
Similarity: 0.7849
Similarity to MM45277
| Tanimoto metric | 0.7849 |
|---|---|
| Cosine metric | 0.886 |
| Dice metric | 0.8795 |
| MW: | 129.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374234
Similarity: 0.7339
Similarity to MM374234
| Tanimoto metric | 0.7339 |
|---|---|
| Cosine metric | 0.8467 |
| Dice metric | 0.8466 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM64341
Similarity: 0.6518
Similarity to MM64341
| Tanimoto metric | 0.6518 |
|---|---|
| Cosine metric | 0.7892 |
| Dice metric | 0.7892 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+174 more
