Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM146171
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM146171 |
| SMILES |
CNC(=N)C#CC(=N)N
|
| InChIKey |
CURAUXONTZVXHF-UHFFFAOYSA-N
|
| MW [Da] |
124.15
Automatically obtained from RDkit software. |
| LogP |
-0.88
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170638
Similarity: 0.8714
Similarity to MM170638
| Tanimoto metric | 0.8714 |
|---|---|
| Cosine metric | 0.9326 |
| Dice metric | 0.9313 |
| MW: | 125.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM95939
Similarity: 0.8261
Similarity to MM95939
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.9089 |
| Dice metric | 0.9048 |
| MW: | 111.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM252882
Similarity: 0.7931
Similarity to MM252882
| Tanimoto metric | 0.7931 |
|---|---|
| Cosine metric | 0.8906 |
| Dice metric | 0.8846 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+240 more
