Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM412236
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM412236 |
| SMILES |
C=CCOCC(=CC)CO
|
| InChIKey |
OQSJHTYTEWKTNP-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199789
Similarity: 0.8961
Similarity to MM199789
| Tanimoto metric | 0.8961 |
|---|---|
| Cosine metric | 0.9466 |
| Dice metric | 0.9452 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM410464
Similarity: 0.8353
Similarity to MM410464
| Tanimoto metric | 0.8353 |
|---|---|
| Cosine metric | 0.9103 |
| Dice metric | 0.9103 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM410471
Similarity: 0.7667
Similarity to MM410471
| Tanimoto metric | 0.7667 |
|---|---|
| Cosine metric | 0.8684 |
| Dice metric | 0.8679 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+549 more
