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DocumentationIdentifier: MM181104
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM181104 |
| SMILES |
N#CC(C(=N)N)C(=N)N
|
| InChIKey |
IQJUCPJSRRPJSG-UHFFFAOYSA-N
|
| MW [Da] |
125.14
Automatically obtained from RDkit software. |
| LogP |
-1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM109101
Similarity: 0.6429
Similarity to MM109101
| Tanimoto metric | 0.6429 |
|---|---|
| Cosine metric | 0.8018 |
| Dice metric | 0.7826 |
| MW: | 114.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM82263
Similarity: 0.5952
Similarity to MM82263
| Tanimoto metric | 0.5952 |
|---|---|
| Cosine metric | 0.7715 |
| Dice metric | 0.7463 |
| MW: | 97.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83196
Similarity: 0.5152
Similarity to MM83196
| Tanimoto metric | 0.5152 |
|---|---|
| Cosine metric | 0.6849 |
| Dice metric | 0.68 |
| MW: | 111.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+46 more
