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DocumentationIdentifier: MM402383
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM402383 |
| SMILES |
CNC(C)CC1C(C)N1C
|
| InChIKey |
MQRVPBSXZCZCNT-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165113
Similarity: 0.9226
Similarity to MM165113
| Tanimoto metric | 0.9226 |
|---|---|
| Cosine metric | 0.9605 |
| Dice metric | 0.9597 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402365
Similarity: 0.843
Similarity to MM402365
| Tanimoto metric | 0.843 |
|---|---|
| Cosine metric | 0.915 |
| Dice metric | 0.9148 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM212431
Similarity: 0.8065
Similarity to MM212431
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+276 more
