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DocumentationIdentifier: MM378112
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378112 |
| SMILES |
C=C(CN)N(C=N)CCC
|
| InChIKey |
BKSYNWJCOOUOHU-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
MM179970
Similarity: 0.7165
Similarity to MM179970
| Tanimoto metric | 0.7165 |
|---|---|
| Cosine metric | 0.8465 |
| Dice metric | 0.8349 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378110
Similarity: 0.6867
Similarity to MM378110
| 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
|
MM89751
Similarity: 0.6026
Similarity to MM89751
| Tanimoto metric | 0.6026 |
|---|---|
| Cosine metric | 0.753 |
| Dice metric | 0.7521 |
| MW: | 137.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+213 more
