Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM312880
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312880 |
| SMILES |
N#CC(C#N)(CF)NC=O
|
| InChIKey |
WKUBVGBDXGHOCQ-UHFFFAOYSA-N
|
| MW [Da] |
141.11
Automatically obtained from RDkit software. |
| LogP |
-0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312633
Similarity: 0.7252
Similarity to MM312633
| Tanimoto metric | 0.7252 |
|---|---|
| Cosine metric | 0.8407 |
| Dice metric | 0.8407 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243747
Similarity: 0.6507
Similarity to MM243747
| Tanimoto metric | 0.6507 |
|---|---|
| Cosine metric | 0.7899 |
| Dice metric | 0.7884 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM42387
Similarity: 0.646
Similarity to MM42387
| Tanimoto metric | 0.646 |
|---|---|
| Cosine metric | 0.8038 |
| Dice metric | 0.7849 |
| MW: | 123.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+89 more
