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DocumentationIdentifier: MM193000
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM193000 |
| SMILES |
NN=CC=C(CO)NC=O
|
| InChIKey |
WCTUDAXNIBOPNM-UHFFFAOYSA-N
|
| MW [Da] |
143.15
Automatically obtained from RDkit software. |
| LogP |
-1.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197745
Similarity: 0.7049
Similarity to MM197745
| Tanimoto metric | 0.7049 |
|---|---|
| Cosine metric | 0.8396 |
| Dice metric | 0.8269 |
| MW: | 127.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM59746
Similarity: 0.635
Similarity to MM59746
| Tanimoto metric | 0.635 |
|---|---|
| Cosine metric | 0.7799 |
| Dice metric | 0.7768 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274599
Similarity: 0.6037
Similarity to MM274599
| Tanimoto metric | 0.6037 |
|---|---|
| Cosine metric | 0.7548 |
| Dice metric | 0.7529 |
| MW: | 143.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+128 more
