Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM378644
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378644 |
| SMILES |
C=CCC(C=C)C(=C)C#N
|
| InChIKey |
PJBJGYUSWIAYDS-UHFFFAOYSA-N
|
| MW [Da] |
133.19
Automatically obtained from RDkit software. |
| LogP |
2.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM350837
Similarity: 0.7444
Similarity to MM350837
| Tanimoto metric | 0.7444 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.8534 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172756
Similarity: 0.7431
Similarity to MM172756
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.862 |
| Dice metric | 0.8526 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378650
Similarity: 0.725
Similarity to MM378650
| Tanimoto metric | 0.725 |
|---|---|
| Cosine metric | 0.8418 |
| Dice metric | 0.8406 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+237 more
