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DocumentationIdentifier: MM176108
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM176108 |
| SMILES |
CC1(CNCCN)CC1
|
| InChIKey |
KNVQAPDBSUTFGB-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM374528
Similarity: 0.9405
Similarity to MM374528
| Tanimoto metric | 0.9405 |
|---|---|
| Cosine metric | 0.9698 |
| Dice metric | 0.9693 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM115692
Similarity: 0.8481
Similarity to MM115692
| Tanimoto metric | 0.8481 |
|---|---|
| Cosine metric | 0.9209 |
| Dice metric | 0.9178 |
| MW: | 113.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374522
Similarity: 0.8161
Similarity to MM374522
| Tanimoto metric | 0.8161 |
|---|---|
| Cosine metric | 0.8987 |
| Dice metric | 0.8987 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+347 more
