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DocumentationIdentifier: MM325950
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325950 |
| SMILES |
CCC(C)NC(CN)CO
|
| InChIKey |
FRYRJUWBDLCPMS-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
-0.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM325936
Similarity: 0.7745
Similarity to MM325936
| Tanimoto metric | 0.7745 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8729 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325932
Similarity: 0.7745
Similarity to MM325932
| Tanimoto metric | 0.7745 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8729 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402224
Similarity: 0.7172
Similarity to MM402224
| Tanimoto metric | 0.7172 |
|---|---|
| Cosine metric | 0.8367 |
| Dice metric | 0.8353 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+481 more
