Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM40916
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM40916 |
| SMILES |
CCNC(C#N)C=CC#N
|
| InChIKey |
PSOGADYYMYSDPJ-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
0.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200697
Similarity: 0.8182
Similarity to MM200697
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 121.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388934
Similarity: 0.7706
Similarity to MM388934
| Tanimoto metric | 0.7706 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8705 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272709
Similarity: 0.7455
Similarity to MM272709
| Tanimoto metric | 0.7455 |
|---|---|
| Cosine metric | 0.8546 |
| Dice metric | 0.8542 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+144 more
