Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM179233
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM179233 |
| SMILES |
C=CCC(C=C)=CC#N
|
| InChIKey |
LFSCAKFUIWFXCI-UHFFFAOYSA-N
|
| MW [Da] |
119.17
Automatically obtained from RDkit software. |
| LogP |
2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM116833
Similarity: 0.7632
Similarity to MM116833
| Tanimoto metric | 0.7632 |
|---|---|
| Cosine metric | 0.8736 |
| Dice metric | 0.8657 |
| MW: | 107.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM175612
Similarity: 0.6875
Similarity to MM175612
| Tanimoto metric | 0.6875 |
|---|---|
| Cosine metric | 0.8164 |
| Dice metric | 0.8148 |
| MW: | 119.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107900
Similarity: 0.6842
Similarity to MM107900
| Tanimoto metric | 0.6842 |
|---|---|
| Cosine metric | 0.8272 |
| Dice metric | 0.8125 |
| MW: | 107.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+420 more
