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DocumentationIdentifier: MM293871
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293871 |
| SMILES |
C=C(C)C(NC=O)C(=C)C
|
| InChIKey |
UAAYPXNKVHQQCB-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.25
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM305790
Similarity: 0.6301
Similarity to MM305790
| Tanimoto metric | 0.6301 |
|---|---|
| Cosine metric | 0.7753 |
| Dice metric | 0.7731 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388845
Similarity: 0.6259
Similarity to MM388845
| Tanimoto metric | 0.6259 |
|---|---|
| Cosine metric | 0.7723 |
| Dice metric | 0.7699 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305077
Similarity: 0.6124
Similarity to MM305077
| Tanimoto metric | 0.6124 |
|---|---|
| Cosine metric | 0.7609 |
| Dice metric | 0.7596 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+172 more
