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DocumentationIdentifier: MM230928
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM230928 |
| SMILES |
CC(C)(N)CCC1(C)CN1
|
| InChIKey |
JBWOFJQOWSMCFX-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149509
Similarity: 0.9492
Similarity to MM149509
| Tanimoto metric | 0.9492 |
|---|---|
| Cosine metric | 0.9742 |
| Dice metric | 0.9739 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325059
Similarity: 0.9344
Similarity to MM325059
| Tanimoto metric | 0.9344 |
|---|---|
| Cosine metric | 0.9661 |
| Dice metric | 0.9661 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325051
Similarity: 0.8507
Similarity to MM325051
| Tanimoto metric | 0.8507 |
|---|---|
| Cosine metric | 0.9204 |
| Dice metric | 0.9194 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+297 more
