Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM226744
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM226744 |
| SMILES |
COC(=O)CC(C)(O)CO
|
| InChIKey |
OZINIUXCCGESFP-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM258507
Similarity: 0.7308
Similarity to MM258507
| Tanimoto metric | 0.7308 |
|---|---|
| Cosine metric | 0.8445 |
| Dice metric | 0.8444 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM39985
Similarity: 0.6934
Similarity to MM39985
| Tanimoto metric | 0.6934 |
|---|---|
| Cosine metric | 0.8327 |
| Dice metric | 0.819 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142013
Similarity: 0.6788
Similarity to MM142013
| Tanimoto metric | 0.6788 |
|---|---|
| Cosine metric | 0.8239 |
| Dice metric | 0.8087 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+150 more
