Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM244765
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244765 |
| SMILES |
CC(C)C(O)CC(O)C=O
|
| InChIKey |
LTFPVTGBHKPPQR-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM261511
Similarity: 0.7115
Similarity to MM261511
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.834 |
| Dice metric | 0.8315 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261512
Similarity: 0.6729
Similarity to MM261512
| Tanimoto metric | 0.6729 |
|---|---|
| Cosine metric | 0.8066 |
| Dice metric | 0.8045 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133486
Similarity: 0.6667
Similarity to MM133486
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+306 more
