Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM162167
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM162167 |
| SMILES |
C=C(C)C(O)COCC
|
| InChIKey |
RLFWQHRVAHYBQI-UHFFFAOYSA-N
|
| MW [Da] |
130.19
Automatically obtained from RDkit software. |
| LogP |
0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM301472
Similarity: 0.8958
Similarity to MM301472
| Tanimoto metric | 0.8958 |
|---|---|
| Cosine metric | 0.9465 |
| Dice metric | 0.9451 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM34432
Similarity: 0.8256
Similarity to MM34432
| Tanimoto metric | 0.8256 |
|---|---|
| Cosine metric | 0.9086 |
| Dice metric | 0.9045 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM73138
Similarity: 0.819
Similarity to MM73138
| Tanimoto metric | 0.819 |
|---|---|
| Cosine metric | 0.905 |
| Dice metric | 0.9005 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+726 more
