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DocumentationIdentifier: MM281894
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281894 |
| SMILES |
C=CNC(=O)C=CCNC
|
| InChIKey |
ZSUPKOMLBJZDLI-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM252370
Similarity: 0.8889
Similarity to MM252370
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9418 |
| Dice metric | 0.9412 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62668
Similarity: 0.8085
Similarity to MM62668
| Tanimoto metric | 0.8085 |
|---|---|
| Cosine metric | 0.8947 |
| Dice metric | 0.8941 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107650
Similarity: 0.7805
Similarity to MM107650
| Tanimoto metric | 0.7805 |
|---|---|
| Cosine metric | 0.8835 |
| Dice metric | 0.8767 |
| MW: | 111.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+362 more
