Identifier: MM247457
2D Structure
3D Structure
Source:
General | |
Identifier | MM247457 |
SMILES |
CCC(C)=CN(C)C(C)=O
|
InChIKey |
LXKMVOLWPVNHDI-UHFFFAOYSA-N
|
MW [Da] |
141.21
Automatically obtained from RDkit software. |
LogP |
1.78
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM134128
Similarity: 0.7479
Similarity to MM134128
Tanimoto metric | 0.7479 |
---|---|
Cosine metric | 0.8648 |
Dice metric | 0.8558 |
MW: | 127.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.39 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM163233
Similarity: 0.7311
Similarity to MM163233
Tanimoto metric | 0.7311 |
---|---|
Cosine metric | 0.855 |
Dice metric | 0.8447 |
MW: | 127.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.39 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM146635
Similarity: 0.6975
Similarity to MM146635
Tanimoto metric | 0.6975 |
---|---|
Cosine metric | 0.8352 |
Dice metric | 0.8218 |
MW: | 127.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.44 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+430 more