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DocumentationIdentifier: MM292856
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292856 |
| SMILES |
COCC(=N)N(C)CCO
|
| InChIKey |
NCSTXNNVWLCMDI-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.47
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM349047
Similarity: 0.8584
Similarity to MM349047
| Tanimoto metric | 0.8584 |
|---|---|
| Cosine metric | 0.924 |
| Dice metric | 0.9238 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172428
Similarity: 0.7664
Similarity to MM172428
| Tanimoto metric | 0.7664 |
|---|---|
| Cosine metric | 0.8754 |
| Dice metric | 0.8677 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350297
Similarity: 0.7398
Similarity to MM350297
| Tanimoto metric | 0.7398 |
|---|---|
| Cosine metric | 0.8505 |
| Dice metric | 0.8505 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+416 more
