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DocumentationIdentifier: MM264562
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264562 |
| SMILES |
C=C(C=O)NC(=O)C=CC
|
| InChIKey |
XVGLRVFAUFMQBU-UHFFFAOYSA-N
|
| MW [Da] |
139.15
Automatically obtained from RDkit software. |
| LogP |
0.39
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM43275
Similarity: 0.8151
Similarity to MM43275
| Tanimoto metric | 0.8151 |
|---|---|
| Cosine metric | 0.9028 |
| Dice metric | 0.8981 |
| MW: | 125.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264560
Similarity: 0.6619
Similarity to MM264560
| Tanimoto metric | 0.6619 |
|---|---|
| Cosine metric | 0.7969 |
| Dice metric | 0.7965 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264455
Similarity: 0.637
Similarity to MM264455
| Tanimoto metric | 0.637 |
|---|---|
| Cosine metric | 0.7782 |
| Dice metric | 0.7782 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
