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DocumentationIdentifier: MM288607
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288607 |
| SMILES |
CC(=O)NC=COCC=O
|
| InChIKey |
JIXQYWUUFRWTRL-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM288506
Similarity: 0.7957
Similarity to MM288506
| Tanimoto metric | 0.7957 |
|---|---|
| Cosine metric | 0.8862 |
| Dice metric | 0.8862 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM288608
Similarity: 0.7629
Similarity to MM288608
| Tanimoto metric | 0.7629 |
|---|---|
| Cosine metric | 0.8656 |
| Dice metric | 0.8655 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68781
Similarity: 0.7551
Similarity to MM68781
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8605 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+348 more
