Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM79946
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM79946 |
| SMILES |
C#CC(=O)OC(CO)CO
|
| InChIKey |
HXZQMPMVZJDISW-UHFFFAOYSA-N
|
| MW [Da] |
144.13
Automatically obtained from RDkit software. |
| LogP |
-1.48
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: 0.899
Similarity to MM42937
| Tanimoto metric | 0.899 |
|---|---|
| Cosine metric | 0.9482 |
| Dice metric | 0.9468 |
| MW: | 128.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM264786
Similarity: 0.7479
Similarity to MM264786
| Tanimoto metric | 0.7479 |
|---|---|
| Cosine metric | 0.8568 |
| Dice metric | 0.8558 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM149961
Similarity: 0.7273
Similarity to MM149961
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+345 more
