Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM307826
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307826 |
| SMILES |
CC(C)=C(CCN)C(N)=O
|
| InChIKey |
WKBREMBUXKUCQO-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180388
Similarity: 0.803
Similarity to MM180388
| Tanimoto metric | 0.803 |
|---|---|
| Cosine metric | 0.8961 |
| Dice metric | 0.8908 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM321643
Similarity: 0.7879
Similarity to MM321643
| Tanimoto metric | 0.7879 |
|---|---|
| Cosine metric | 0.8876 |
| Dice metric | 0.8814 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62813
Similarity: 0.7467
Similarity to MM62813
| Tanimoto metric | 0.7467 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.855 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+332 more
