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DocumentationIdentifier: MM66001
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM66001 |
| SMILES |
COC(C)C=C(C)NC=O
|
| InChIKey |
IEAKBOXXIMRYEQ-UHFFFAOYSA-N
|
| MW [Da] |
143.19
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
MM267516
Similarity: 0.6733
Similarity to MM267516
| Tanimoto metric | 0.6733 |
|---|---|
| Cosine metric | 0.8048 |
| Dice metric | 0.8048 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159565
Similarity: 0.6614
Similarity to MM159565
| Tanimoto metric | 0.6614 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.7962 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM267376
Similarity: 0.6579
Similarity to MM267376
| Tanimoto metric | 0.6579 |
|---|---|
| Cosine metric | 0.7937 |
| Dice metric | 0.7937 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+247 more
