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DocumentationIdentifier: MM221130
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221130 |
| SMILES |
CC(CC(C)(C)O)NC=N
|
| InChIKey |
CBASUSUDCUPKMW-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM221728
Similarity: 0.6812
Similarity to MM221728
| Tanimoto metric | 0.6812 |
|---|---|
| Cosine metric | 0.8104 |
| Dice metric | 0.8103 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237122
Similarity: 0.6667
Similarity to MM237122
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8008 |
| Dice metric | 0.8 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261396
Similarity: 0.6423
Similarity to MM261396
| Tanimoto metric | 0.6423 |
|---|---|
| Cosine metric | 0.7824 |
| Dice metric | 0.7822 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+175 more
