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DocumentationIdentifier: MM60251
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM60251 |
| SMILES |
C=CCOC(=O)C=C(N)N
|
| InChIKey |
WWIJOWZFGHZVCJ-UHFFFAOYSA-N
|
| MW [Da] |
142.16
Automatically obtained from RDkit software. |
| LogP |
-0.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM136229
Similarity: 0.9
Similarity to MM136229
| Tanimoto metric | 0.9 |
|---|---|
| Cosine metric | 0.9487 |
| Dice metric | 0.9474 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM60252
Similarity: 0.75
Similarity to MM60252
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8571 |
| MW: | 141.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238149
Similarity: 0.7431
Similarity to MM238149
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8538 |
| Dice metric | 0.8526 |
| MW: | 148.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+362 more
