Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM308138
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308138 |
| SMILES |
CCC(O)(CO)COC=O
|
| InChIKey |
IJFBZJHOSUQUNU-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
MM308134
Similarity: 0.6935
Similarity to MM308134
| Tanimoto metric | 0.6935 |
|---|---|
| Cosine metric | 0.8209 |
| Dice metric | 0.819 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM138263
Similarity: 0.6875
Similarity to MM138263
| Tanimoto metric | 0.6875 |
|---|---|
| Cosine metric | 0.8292 |
| Dice metric | 0.8148 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308142
Similarity: 0.6667
Similarity to MM308142
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.809 |
| Dice metric | 0.8 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+157 more
