Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM167584
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM167584 |
| SMILES |
C=CC(=N)NCC=CF
|
| InChIKey |
QAKIYZIQZKOXCI-UHFFFAOYSA-N
|
| MW [Da] |
128.15
Automatically obtained from RDkit software. |
| LogP |
1.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM157319
Similarity: 0.8481
Similarity to MM157319
| Tanimoto metric | 0.8481 |
|---|---|
| Cosine metric | 0.9182 |
| Dice metric | 0.9178 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM105907
Similarity: 0.8028
Similarity to MM105907
| Tanimoto metric | 0.8028 |
|---|---|
| Cosine metric | 0.896 |
| Dice metric | 0.8906 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113375
Similarity: 0.7465
Similarity to MM113375
| Tanimoto metric | 0.7465 |
|---|---|
| Cosine metric | 0.864 |
| Dice metric | 0.8548 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+472 more
