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DocumentationIdentifier: MM194644
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM194644 |
| SMILES |
CCCC1CN1CCN
|
| InChIKey |
SHTJPYXEVJGCPH-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM440076
Similarity: 0.8195
Similarity to MM440076
| Tanimoto metric | 0.8195 |
|---|---|
| Cosine metric | 0.9053 |
| Dice metric | 0.9008 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM440021
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| Tanimoto metric | 0.8195 |
|---|---|
| Cosine metric | 0.9053 |
| Dice metric | 0.9008 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM127619
Similarity: 0.8073
Similarity to MM127619
| Tanimoto metric | 0.8073 |
|---|---|
| Cosine metric | 0.8985 |
| Dice metric | 0.8934 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+365 more
