Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM59878
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM59878 |
| SMILES |
C#CC(C(F)C#N)N(C)C
|
| InChIKey |
ADDISQLKCIFLBR-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
0.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM429798
Similarity: 0.7974
Similarity to MM429798
| Tanimoto metric | 0.7974 |
|---|---|
| Cosine metric | 0.893 |
| Dice metric | 0.8873 |
| MW: | 126.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160040
Similarity: 0.6797
Similarity to MM160040
| Tanimoto metric | 0.6797 |
|---|---|
| Cosine metric | 0.8245 |
| Dice metric | 0.8093 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM45863
Similarity: 0.5621
Similarity to MM45863
| Tanimoto metric | 0.5621 |
|---|---|
| Cosine metric | 0.7497 |
| Dice metric | 0.7197 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+38 more
