Identifier: MM262596
2D Structure
3D Structure
Source:
General | |
Identifier | MM262596 |
SMILES |
C=CCC(=O)OC(C)CC
|
InChIKey |
NWCFRHINQXDFIJ-UHFFFAOYSA-N
|
MW [Da] |
142.2
Automatically obtained from RDkit software. |
LogP |
1.9
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM135444
Similarity: 0.7822
Similarity to MM135444
Tanimoto metric | 0.7822 |
---|---|
Cosine metric | 0.8844 |
Dice metric | 0.8778 |
MW: | 128.17 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.51 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM142078
Similarity: 0.7723
Similarity to MM142078
Tanimoto metric | 0.7723 |
---|---|
Cosine metric | 0.8788 |
Dice metric | 0.8715 |
MW: | 130.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.74 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM156464
Similarity: 0.7228
Similarity to MM156464
Tanimoto metric | 0.7228 |
---|---|
Cosine metric | 0.8502 |
Dice metric | 0.8391 |
MW: | 128.17 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.52 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+564 more