Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM403390
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM403390 |
| SMILES |
CCOC(C)C#CC(=O)O
|
| InChIKey |
BGORBLCKPLGPTL-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
0.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM16297
Similarity: 0.8431
Similarity to MM16297
| Tanimoto metric | 0.8431 |
|---|---|
| Cosine metric | 0.9182 |
| Dice metric | 0.9149 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM158352
Similarity: 0.7255
Similarity to MM158352
| Tanimoto metric | 0.7255 |
|---|---|
| Cosine metric | 0.8518 |
| Dice metric | 0.8409 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM323248
Similarity: 0.7167
Similarity to MM323248
| Tanimoto metric | 0.7167 |
|---|---|
| Cosine metric | 0.835 |
| Dice metric | 0.835 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+466 more
