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DocumentationIdentifier: MM292722
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292722 |
| SMILES |
C=CCC(C)C(C)NC=N
|
| InChIKey |
UCQUIISXUQIJQQ-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171958
Similarity: 0.7619
Similarity to MM171958
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8729 |
| Dice metric | 0.8649 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261651
Similarity: 0.6777
Similarity to MM261651
| Tanimoto metric | 0.6777 |
|---|---|
| Cosine metric | 0.8084 |
| Dice metric | 0.8079 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155955
Similarity: 0.6762
Similarity to MM155955
| Tanimoto metric | 0.6762 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.8068 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+256 more
