Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM448419
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM448419 |
| SMILES |
C=CCN(C)C(=O)C=CN
|
| InChIKey |
LLCKNLZEWWGEKE-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM448105
Similarity: 0.8824
Similarity to MM448105
| Tanimoto metric | 0.8824 |
|---|---|
| Cosine metric | 0.9393 |
| Dice metric | 0.9375 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM448398
Similarity: 0.687
Similarity to MM448398
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8169 |
| Dice metric | 0.8145 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111864
Similarity: 0.6471
Similarity to MM111864
| Tanimoto metric | 0.6471 |
|---|---|
| Cosine metric | 0.8044 |
| Dice metric | 0.7857 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+304 more
