Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM262597
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262597 |
| SMILES |
C=CCC(=O)OC(C)CO
|
| InChIKey |
QNEVLGWWHKHNHW-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.49
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: 0.7524
Similarity to MM135444
| Tanimoto metric | 0.7524 |
|---|---|
| Cosine metric | 0.8674 |
| Dice metric | 0.8587 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156465
Similarity: 0.7333
Similarity to MM156465
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.8462 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262480
Similarity: 0.7009
Similarity to MM262480
| Tanimoto metric | 0.7009 |
|---|---|
| Cosine metric | 0.8254 |
| Dice metric | 0.8241 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+371 more
