Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM328777
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328777 |
| SMILES |
NCC(CO)OC(=O)CO
|
| InChIKey |
LUKDMWYIJMQBLG-UHFFFAOYSA-N
|
| MW [Da] |
149.15
Automatically obtained from RDkit software. |
| LogP |
-2.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149959
Similarity: 0.819
Similarity to MM149959
| Tanimoto metric | 0.819 |
|---|---|
| Cosine metric | 0.905 |
| Dice metric | 0.9005 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328775
Similarity: 0.7692
Similarity to MM328775
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8696 |
| Dice metric | 0.8696 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328773
Similarity: 0.7063
Similarity to MM328773
| Tanimoto metric | 0.7063 |
|---|---|
| Cosine metric | 0.8305 |
| Dice metric | 0.8279 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+254 more
