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DocumentationIdentifier: MM388759
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388759 |
| SMILES |
C=CN(C(C)=N)C(C)CN
|
| InChIKey |
YWSNASCSAFLMIJ-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389250
Similarity: 0.6938
Similarity to MM389250
| Tanimoto metric | 0.6938 |
|---|---|
| Cosine metric | 0.8199 |
| Dice metric | 0.8192 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160192
Similarity: 0.6879
Similarity to MM160192
| Tanimoto metric | 0.6879 |
|---|---|
| Cosine metric | 0.8294 |
| Dice metric | 0.8151 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179972
Similarity: 0.6596
Similarity to MM179972
| Tanimoto metric | 0.6596 |
|---|---|
| Cosine metric | 0.8121 |
| Dice metric | 0.7949 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+97 more
