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DocumentationIdentifier: MM69823
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM69823 |
| SMILES |
C=CC(=O)C=CC(C)NC
|
| InChIKey |
SFLZNNFAJXYNQM-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM67118
Similarity: 0.81
Similarity to MM67118
| Tanimoto metric | 0.81 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.895 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM67915
Similarity: 0.69
Similarity to MM67915
| Tanimoto metric | 0.69 |
|---|---|
| Cosine metric | 0.8307 |
| Dice metric | 0.8166 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM321646
Similarity: 0.6585
Similarity to MM321646
| Tanimoto metric | 0.6585 |
|---|---|
| Cosine metric | 0.7943 |
| Dice metric | 0.7941 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+238 more
