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DocumentationIdentifier: MM62857
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM62857 |
| SMILES |
C=COC(=O)CNC=NC
|
| InChIKey |
OBZOPKYZZMXACP-UHFFFAOYSA-N
|
| MW [Da] |
142.16
Automatically obtained from RDkit software. |
| LogP |
-0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM59585
Similarity: 0.7411
Similarity to MM59585
| Tanimoto metric | 0.7411 |
|---|---|
| Cosine metric | 0.8522 |
| Dice metric | 0.8513 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356796
Similarity: 0.7131
Similarity to MM356796
| Tanimoto metric | 0.7131 |
|---|---|
| Cosine metric | 0.8328 |
| Dice metric | 0.8325 |
| MW: | 146.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262903
Similarity: 0.6692
Similarity to MM262903
| Tanimoto metric | 0.6692 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.8018 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+7 more
