Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM78544
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM78544 |
| SMILES |
CCC(=O)COC(C)CO
|
| InChIKey |
HNLICOVJSUXBGE-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166409
Similarity: 0.7582
Similarity to MM166409
| Tanimoto metric | 0.7582 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8625 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144624
Similarity: 0.7582
Similarity to MM144624
| Tanimoto metric | 0.7582 |
|---|---|
| Cosine metric | 0.8708 |
| Dice metric | 0.8625 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340710
Similarity: 0.7091
Similarity to MM340710
| Tanimoto metric | 0.7091 |
|---|---|
| Cosine metric | 0.8302 |
| Dice metric | 0.8298 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+236 more
