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DocumentationIdentifier: MM87769
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM87769 |
| SMILES |
CC=CN(CC)C(=N)CO
|
| InChIKey |
PSKXFZNUEPAKMH-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM89301
Similarity: 0.7786
Similarity to MM89301
| Tanimoto metric | 0.7786 |
|---|---|
| Cosine metric | 0.8824 |
| Dice metric | 0.8755 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355859
Similarity: 0.6803
Similarity to MM355859
| Tanimoto metric | 0.6803 |
|---|---|
| Cosine metric | 0.8112 |
| Dice metric | 0.8097 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355857
Similarity: 0.6689
Similarity to MM355857
| Tanimoto metric | 0.6689 |
|---|---|
| Cosine metric | 0.8022 |
| Dice metric | 0.8016 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
