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DocumentationIdentifier: MM278665
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM278665 |
| SMILES |
C=COC(C)CNC=NC
|
| InChIKey |
FLBSTZGUSIMNTJ-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM261699
Similarity: 0.6639
Similarity to MM261699
| Tanimoto metric | 0.6639 |
|---|---|
| Cosine metric | 0.7992 |
| Dice metric | 0.798 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387347
Similarity: 0.6484
Similarity to MM387347
| Tanimoto metric | 0.6484 |
|---|---|
| Cosine metric | 0.7899 |
| Dice metric | 0.7867 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387343
Similarity: 0.6378
Similarity to MM387343
| Tanimoto metric | 0.6378 |
|---|---|
| Cosine metric | 0.7812 |
| Dice metric | 0.7788 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+323 more
