Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM56829
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM56829 |
| SMILES |
O=CNC=COC=CF
|
| InChIKey |
YWRXEGNEJZBASN-UHFFFAOYSA-N
|
| MW [Da] |
131.11
Automatically obtained from RDkit software. |
| LogP |
0.66
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM39800
Similarity: 0.7627
Similarity to MM39800
| Tanimoto metric | 0.7627 |
|---|---|
| Cosine metric | 0.8733 |
| Dice metric | 0.8654 |
| MW: | 113.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM215368
Similarity: 0.6479
Similarity to MM215368
| Tanimoto metric | 0.6479 |
|---|---|
| Cosine metric | 0.7864 |
| Dice metric | 0.7863 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375420
Similarity: 0.6344
Similarity to MM375420
| Tanimoto metric | 0.6344 |
|---|---|
| Cosine metric | 0.7965 |
| Dice metric | 0.7763 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+117 more
