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DocumentationIdentifier: MM419017
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM419017 |
| SMILES |
CC(C)C(N)CCC1CN1
|
| InChIKey |
ZFTHAMRCMDDDRP-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM208943
Similarity: 0.802
Similarity to MM208943
| Tanimoto metric | 0.802 |
|---|---|
| Cosine metric | 0.8955 |
| Dice metric | 0.8901 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM433721
Similarity: 0.7864
Similarity to MM433721
| Tanimoto metric | 0.7864 |
|---|---|
| Cosine metric | 0.8847 |
| Dice metric | 0.8804 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM345516
Similarity: 0.7109
Similarity to MM345516
| Tanimoto metric | 0.7109 |
|---|---|
| Cosine metric | 0.8336 |
| Dice metric | 0.8311 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+190 more
