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DocumentationIdentifier: MM350201
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350201 |
| SMILES |
COC(C)C(=O)NCCN
|
| InChIKey |
ZRNRIEJXCWWYLS-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162414
Similarity: 0.7578
Similarity to MM162414
| Tanimoto metric | 0.7578 |
|---|---|
| Cosine metric | 0.8705 |
| Dice metric | 0.8622 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350203
Similarity: 0.7483
Similarity to MM350203
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.8562 |
| Dice metric | 0.856 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84853
Similarity: 0.7483
Similarity to MM84853
| Tanimoto metric | 0.7483 |
|---|---|
| Cosine metric | 0.8562 |
| Dice metric | 0.856 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+339 more
