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DocumentationIdentifier: MM261396
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261396 |
| SMILES |
CCC(O)CC(C)NC=N
|
| InChIKey |
ZVKGHPUIYQPFEC-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
MM237122
Similarity: 0.6929
Similarity to MM237122
| Tanimoto metric | 0.6929 |
|---|---|
| Cosine metric | 0.8188 |
| Dice metric | 0.8186 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221130
Similarity: 0.6423
Similarity to MM221130
| 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
|
MM221728
Similarity: 0.6331
Similarity to MM221728
| Tanimoto metric | 0.6331 |
|---|---|
| Cosine metric | 0.7757 |
| Dice metric | 0.7753 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+172 more
