Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM66216
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM66216 |
| SMILES |
C=CC(C)C(O)CC(=O)O
|
| InChIKey |
LQFIFTKYWXGBHT-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM57296
Similarity: 0.6329
Similarity to MM57296
| Tanimoto metric | 0.6329 |
|---|---|
| Cosine metric | 0.7756 |
| Dice metric | 0.7752 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144409
Similarity: 0.6
Similarity to MM144409
| Tanimoto metric | 0.6 |
|---|---|
| Cosine metric | 0.7746 |
| Dice metric | 0.75 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM256132
Similarity: 0.5743
Similarity to MM256132
| Tanimoto metric | 0.5743 |
|---|---|
| Cosine metric | 0.7316 |
| Dice metric | 0.7296 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+141 more
