Identifier: MM61822
2D Structure
3D Structure
Source:
General | |
Identifier | MM61822 |
SMILES |
C=C(C)N=CNCC=O
|
InChIKey |
SHYSPWQBDYQWDX-UHFFFAOYSA-N
|
MW [Da] |
126.16
Automatically obtained from RDkit software. |
LogP |
0.34
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM374172
Similarity: 0.7816
Similarity to MM374172
Tanimoto metric | 0.7816 |
---|---|
Cosine metric | 0.8841 |
Dice metric | 0.8774 |
MW: | 138.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM375400
Similarity: 0.7727
Similarity to MM375400
Tanimoto metric | 0.7727 |
---|---|
Cosine metric | 0.879 |
Dice metric | 0.8718 |
MW: | 140.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.73 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM373691
Similarity: 0.7556
Similarity to MM373691
Tanimoto metric | 0.7556 |
---|---|
Cosine metric | 0.8692 |
Dice metric | 0.8608 |
MW: | 140.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.73 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+74 more