Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM293091
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293091 |
| SMILES |
C#CC=CC(=C)CNC=O
|
| InChIKey |
GHIGJMLBYGQIIH-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM305018
Similarity: 0.8125
Similarity to MM305018
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM157992
Similarity: 0.8021
Similarity to MM157992
| Tanimoto metric | 0.8021 |
|---|---|
| Cosine metric | 0.8956 |
| Dice metric | 0.8902 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM357742
Similarity: 0.729
Similarity to MM357742
| Tanimoto metric | 0.729 |
|---|---|
| Cosine metric | 0.8438 |
| Dice metric | 0.8432 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+274 more
