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DocumentationIdentifier: MM309130
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM309130 |
| SMILES |
CC(CN1CC1C)NC=N
|
| InChIKey |
WWQXQZUBWIIDQM-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM184564
Similarity: 0.8385
Similarity to MM184564
| Tanimoto metric | 0.8385 |
|---|---|
| Cosine metric | 0.9157 |
| Dice metric | 0.9121 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM193898
Similarity: 0.7231
Similarity to MM193898
| Tanimoto metric | 0.7231 |
|---|---|
| Cosine metric | 0.8503 |
| Dice metric | 0.8393 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402399
Similarity: 0.7171
Similarity to MM402399
| Tanimoto metric | 0.7171 |
|---|---|
| Cosine metric | 0.8353 |
| Dice metric | 0.8352 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+116 more
