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DocumentationIdentifier: MM395223
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM395223 |
| SMILES |
CN(C)C(C=CCN)CO
|
| InChIKey |
LHEXVXQFRHWNIY-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200521
Similarity: 0.79
Similarity to MM200521
| Tanimoto metric | 0.79 |
|---|---|
| Cosine metric | 0.8888 |
| Dice metric | 0.8827 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62495
Similarity: 0.6822
Similarity to MM62495
| Tanimoto metric | 0.6822 |
|---|---|
| Cosine metric | 0.8162 |
| Dice metric | 0.8111 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343364
Similarity: 0.6752
Similarity to MM343364
| Tanimoto metric | 0.6752 |
|---|---|
| Cosine metric | 0.8063 |
| Dice metric | 0.8061 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+474 more
