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DocumentationIdentifier: MM291450
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291450 |
| SMILES |
CC(COCCN)NC=N
|
| InChIKey |
UINZZEHDXLFHFD-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291449
Similarity: 0.8941
Similarity to MM291449
| Tanimoto metric | 0.8941 |
|---|---|
| Cosine metric | 0.9441 |
| Dice metric | 0.9441 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM286984
Similarity: 0.8171
Similarity to MM286984
| Tanimoto metric | 0.8171 |
|---|---|
| Cosine metric | 0.9018 |
| Dice metric | 0.8993 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291570
Similarity: 0.7604
Similarity to MM291570
| Tanimoto metric | 0.7604 |
|---|---|
| Cosine metric | 0.8651 |
| Dice metric | 0.8639 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+385 more
