Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM316626
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316626 |
| SMILES |
C=CC(O)C(=C)C=CC#N
|
| InChIKey |
UPQHUKGXRAZZGI-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
1.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM343448
Similarity: 0.7863
Similarity to MM343448
| Tanimoto metric | 0.7863 |
|---|---|
| Cosine metric | 0.8867 |
| Dice metric | 0.8804 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351545
Similarity: 0.7077
Similarity to MM351545
| Tanimoto metric | 0.7077 |
|---|---|
| Cosine metric | 0.83 |
| Dice metric | 0.8288 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM369170
Similarity: 0.6857
Similarity to MM369170
| Tanimoto metric | 0.6857 |
|---|---|
| Cosine metric | 0.8136 |
| Dice metric | 0.8136 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+56 more
