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DocumentationIdentifier: MM425688
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM425688 |
| SMILES |
CCCNCC1(CC)CN1
|
| InChIKey |
CDICPUZNUIOCRD-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
MM202878
Similarity: 0.9343
Similarity to MM202878
| Tanimoto metric | 0.9343 |
|---|---|
| Cosine metric | 0.9666 |
| Dice metric | 0.966 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM425694
Similarity: 0.8844
Similarity to MM425694
| Tanimoto metric | 0.8844 |
|---|---|
| Cosine metric | 0.9387 |
| Dice metric | 0.9386 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343640
Similarity: 0.8421
Similarity to MM343640
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9145 |
| Dice metric | 0.9143 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+214 more
