Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM264786
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264786 |
| SMILES |
CC#CC(=O)OC(C)CO
|
| InChIKey |
KQCCXLSXICUXDT-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42937
Similarity: 0.8165
Similarity to MM42937
| Tanimoto metric | 0.8165 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.899 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM79946
Similarity: 0.7479
Similarity to MM79946
| Tanimoto metric | 0.7479 |
|---|---|
| Cosine metric | 0.8568 |
| Dice metric | 0.8558 |
| MW: | 144.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135933
Similarity: 0.7339
Similarity to MM135933
| Tanimoto metric | 0.7339 |
|---|---|
| Cosine metric | 0.8567 |
| Dice metric | 0.8466 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+274 more
