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DocumentationIdentifier: MM165568
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM165568 |
| SMILES |
CNC(C)CNCCN
|
| InChIKey |
PPJODVFYPGBELW-UHFFFAOYSA-N
|
| MW [Da] |
131.22
Automatically obtained from RDkit software. |
| LogP |
-0.86
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM81054
Similarity: 0.8491
Similarity to MM81054
| Tanimoto metric | 0.8491 |
|---|---|
| Cosine metric | 0.9214 |
| Dice metric | 0.9184 |
| MW: | 116.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83041
Similarity: 0.7966
Similarity to MM83041
| Tanimoto metric | 0.7966 |
|---|---|
| Cosine metric | 0.8868 |
| Dice metric | 0.8868 |
| MW: | 130.24 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155689
Similarity: 0.7627
Similarity to MM155689
| Tanimoto metric | 0.7627 |
|---|---|
| Cosine metric | 0.8655 |
| Dice metric | 0.8654 |
| MW: | 130.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+523 more
