Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM355891
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM355891 |
| SMILES |
C=C(COCC)OCC#N
|
| InChIKey |
AUDCNWWJDCAVSD-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
1.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM45937
Similarity: 0.9211
Similarity to MM45937
| Tanimoto metric | 0.9211 |
|---|---|
| Cosine metric | 0.9597 |
| Dice metric | 0.9589 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291937
Similarity: 0.875
Similarity to MM291937
| Tanimoto metric | 0.875 |
|---|---|
| Cosine metric | 0.9334 |
| Dice metric | 0.9333 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356166
Similarity: 0.8046
Similarity to MM356166
| Tanimoto metric | 0.8046 |
|---|---|
| Cosine metric | 0.8922 |
| Dice metric | 0.8917 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+367 more
