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DocumentationIdentifier: MM345528
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM345528 |
| SMILES |
CNC(C)(C)CCC1CN1
|
| InChIKey |
WSVNFDORJBXVAE-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM151899
Similarity: 0.8257
Similarity to MM151899
| Tanimoto metric | 0.8257 |
|---|---|
| Cosine metric | 0.9087 |
| Dice metric | 0.9045 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325059
Similarity: 0.816
Similarity to MM325059
| Tanimoto metric | 0.816 |
|---|---|
| Cosine metric | 0.8994 |
| Dice metric | 0.8987 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM230928
Similarity: 0.7874
Similarity to MM230928
| Tanimoto metric | 0.7874 |
|---|---|
| Cosine metric | 0.8818 |
| Dice metric | 0.8811 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+185 more
