Identifier: MM43953
2D Structure
3D Structure
Source:
General | |
Identifier | MM43953 |
SMILES |
C#CC(=O)OCC(=O)O
|
InChIKey |
DJZFPWLBARFWLC-UHFFFAOYSA-N
|
MW [Da] |
128.08
Automatically obtained from RDkit software. |
LogP |
-0.75
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM392698
Similarity: 0.8039
Similarity to MM392698
Tanimoto metric | 0.8039 |
---|---|
Cosine metric | 0.8966 |
Dice metric | 0.8913 |
MW: | 142.11 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.36 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM36572
Similarity: 0.7195
Similarity to MM36572
Tanimoto metric | 0.7195 |
---|---|
Cosine metric | 0.8482 |
Dice metric | 0.8369 |
MW: | 114.1 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | -0.84 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM113448
Similarity: 0.7195
Similarity to MM113448
Tanimoto metric | 0.7195 |
---|---|
Cosine metric | 0.8482 |
Dice metric | 0.8369 |
MW: | 112.08 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.64 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+249 more