Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM156492
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM156492 |
| SMILES |
C=C(CC#N)CCC#N
|
| InChIKey |
QESBEFQSMIUTRV-UHFFFAOYSA-N
|
| MW [Da] |
120.16
Automatically obtained from RDkit software. |
| LogP |
1.76
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107347
Similarity: 0.8889
Similarity to MM107347
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 109.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113131
Similarity: 0.8519
Similarity to MM113131
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 109.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156373
Similarity: 0.7619
Similarity to MM156373
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8652 |
| Dice metric | 0.8649 |
| MW: | 123.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+450 more
