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DocumentationIdentifier: MM226986
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM226986 |
| SMILES |
CN=C(N)CC(C)(C)C=O
|
| InChIKey |
WZDRYOXYXJVHGA-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM262685
Similarity: 0.7213
Similarity to MM262685
| Tanimoto metric | 0.7213 |
|---|---|
| Cosine metric | 0.8382 |
| Dice metric | 0.8381 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM331953
Similarity: 0.6286
Similarity to MM331953
| Tanimoto metric | 0.6286 |
|---|---|
| Cosine metric | 0.7734 |
| Dice metric | 0.7719 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329198
Similarity: 0.6027
Similarity to MM329198
| Tanimoto metric | 0.6027 |
|---|---|
| Cosine metric | 0.7549 |
| Dice metric | 0.7521 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+232 more
