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DocumentationIdentifier: MM246525
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246525 |
| SMILES |
C=CC(=O)CC(=N)N(C)C
|
| InChIKey |
NKNRMKKZBNCVAL-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133920
Similarity: 0.75
Similarity to MM133920
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246384
Similarity: 0.6203
Similarity to MM246384
| Tanimoto metric | 0.6203 |
|---|---|
| Cosine metric | 0.7656 |
| Dice metric | 0.7656 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246571
Similarity: 0.6076
Similarity to MM246571
| Tanimoto metric | 0.6076 |
|---|---|
| Cosine metric | 0.7559 |
| Dice metric | 0.7559 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+50 more
