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DocumentationIdentifier: MM378110
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378110 |
| SMILES |
C=C(CC)N(C=N)CCN
|
| InChIKey |
KHGSECQWNUQZFN-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
MM378112
Similarity: 0.6867
Similarity to MM378112
| Tanimoto metric | 0.6867 |
|---|---|
| Cosine metric | 0.8142 |
| Dice metric | 0.8142 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM89818
Similarity: 0.6364
Similarity to MM89818
| Tanimoto metric | 0.6364 |
|---|---|
| Cosine metric | 0.7801 |
| Dice metric | 0.7778 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389778
Similarity: 0.6323
Similarity to MM389778
| Tanimoto metric | 0.6323 |
|---|---|
| Cosine metric | 0.7747 |
| Dice metric | 0.7747 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+295 more
