Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM150561
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM150561 |
| SMILES |
C=C(C)OC(C#N)=CF
|
| InChIKey |
DYAWIEXTZYZTED-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
MM334483
Similarity: 0.9038
Similarity to MM334483
| Tanimoto metric | 0.9038 |
|---|---|
| Cosine metric | 0.9507 |
| Dice metric | 0.9495 |
| MW: | 138.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM143200
Similarity: 0.84
Similarity to MM143200
| Tanimoto metric | 0.84 |
|---|---|
| Cosine metric | 0.9133 |
| Dice metric | 0.913 |
| MW: | 127.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM335014
Similarity: 0.7705
Similarity to MM335014
| Tanimoto metric | 0.7705 |
|---|---|
| Cosine metric | 0.8778 |
| Dice metric | 0.8704 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+311 more
