Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM45840
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM45840 |
| SMILES |
COCCC(=O)COC
|
| InChIKey |
WDVLUEIBBKAGNQ-UHFFFAOYSA-N
|
| MW [Da] |
132.16
Automatically obtained from RDkit software. |
| LogP |
0.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107312
Similarity: 0.9016
Similarity to MM107312
| Tanimoto metric | 0.9016 |
|---|---|
| Cosine metric | 0.9495 |
| Dice metric | 0.9483 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113005
Similarity: 0.8689
Similarity to MM113005
| Tanimoto metric | 0.8689 |
|---|---|
| Cosine metric | 0.9321 |
| Dice metric | 0.9298 |
| MW: | 118.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM166368
Similarity: 0.726
Similarity to MM166368
| Tanimoto metric | 0.726 |
|---|---|
| Cosine metric | 0.8417 |
| Dice metric | 0.8413 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+547 more
