Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM154982
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM154982 |
| SMILES |
CC(F)=COC=CC#N
|
| InChIKey |
GNHSATIKSKSLNS-UHFFFAOYSA-N
|
| MW [Da] |
127.12
Automatically obtained from RDkit software. |
| LogP |
1.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM371018
Similarity: 0.863
Similarity to MM371018
| Tanimoto metric | 0.863 |
|---|---|
| Cosine metric | 0.929 |
| Dice metric | 0.9265 |
| MW: | 138.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171379
Similarity: 0.8356
Similarity to MM171379
| Tanimoto metric | 0.8356 |
|---|---|
| Cosine metric | 0.9121 |
| Dice metric | 0.9104 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261107
Similarity: 0.8182
Similarity to MM261107
| Tanimoto metric | 0.8182 |
|---|---|
| Cosine metric | 0.9045 |
| Dice metric | 0.9 |
| MW: | 145.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+300 more
