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DocumentationIdentifier: MM299903
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM299903 |
| SMILES |
C=COCC=CC(=O)NC
|
| InChIKey |
QJYAAPXEXYEEJN-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM304418
Similarity: 0.7692
Similarity to MM304418
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8698 |
| Dice metric | 0.8696 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM70807
Similarity: 0.708
Similarity to MM70807
| Tanimoto metric | 0.708 |
|---|---|
| Cosine metric | 0.8293 |
| Dice metric | 0.829 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309398
Similarity: 0.7059
Similarity to MM309398
| Tanimoto metric | 0.7059 |
|---|---|
| Cosine metric | 0.8303 |
| Dice metric | 0.8276 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+390 more
