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DocumentationIdentifier: MM293247
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293247 |
| SMILES |
C=CC1NC1CNC=O
|
| InChIKey |
IGQRJTXMMJEJPL-UHFFFAOYSA-N
|
| MW [Da] |
126.16
Automatically obtained from RDkit software. |
| LogP |
-0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM127755
Similarity: 0.7923
Similarity to MM127755
| Tanimoto metric | 0.7923 |
|---|---|
| Cosine metric | 0.8901 |
| Dice metric | 0.8841 |
| MW: | 112.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM216694
Similarity: 0.7007
Similarity to MM216694
| Tanimoto metric | 0.7007 |
|---|---|
| Cosine metric | 0.8247 |
| Dice metric | 0.824 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM194828
Similarity: 0.6688
Similarity to MM194828
| Tanimoto metric | 0.6688 |
|---|---|
| Cosine metric | 0.8016 |
| Dice metric | 0.8015 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+99 more
