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DocumentationIdentifier: MM425633
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM425633 |
| SMILES |
CNCCCC1(CN)CN1
|
| InChIKey |
LQJCQGBECGWAPS-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM202867
Similarity: 0.9237
Similarity to MM202867
| Tanimoto metric | 0.9237 |
|---|---|
| Cosine metric | 0.9611 |
| Dice metric | 0.9603 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM459780
Similarity: 0.8291
Similarity to MM459780
| Tanimoto metric | 0.8291 |
|---|---|
| Cosine metric | 0.9106 |
| Dice metric | 0.9066 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343630
Similarity: 0.8065
Similarity to MM343630
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.8947 |
| Dice metric | 0.8929 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+295 more
