Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM96216
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM96216 |
| SMILES |
CN(C)CCC#CC(=N)N
|
| InChIKey |
WYJJXVSXCAINAC-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
-0.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM154593
Similarity: 0.8701
Similarity to MM154593
| Tanimoto metric | 0.8701 |
|---|---|
| Cosine metric | 0.9328 |
| Dice metric | 0.9306 |
| MW: | 125.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM289836
Similarity: 0.7976
Similarity to MM289836
| Tanimoto metric | 0.7976 |
|---|---|
| Cosine metric | 0.8876 |
| Dice metric | 0.8874 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM289863
Similarity: 0.7701
Similarity to MM289863
| Tanimoto metric | 0.7701 |
|---|---|
| Cosine metric | 0.8701 |
| Dice metric | 0.8701 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+426 more
